A0A078BTJ7_CAEEL Loading...

SH3 domain-containing protein

AlphaFold DB , UniProt , Accession A0A078BTJ7, Species CAEEL (Caenorhabditis elegans), Gene ccb-2, Length 383 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35	Very low	35.4	Very low	240 Å²	240	119.4 Å²	119.4	100%	1.182	70%	0.695	S	S	*	*				0	80.7	0	-63.7	163.6	82.5	0	0	106.7
2	S	39.7	Very low	35.6	Very low	107 Å²	107	127.3 Å²	127.3	75%	0.748	71%	0.705	S	S	*	*				66.6	123.1	57.9	-157.1	0	0	0	0	113.5
3	M	30.3	Very low	35.7	Very low	159 Å²	159	130.4 Å²	130.4	78%	0.783	71%	0.707	S	S	*	*			trans	90	-2.6	163	-61	-165.1	-147.2	0	0	122.8
4	G	33	Very low	35.9	Very low	69 Å²	69	130.4 Å²	130.4	71%	0.711	70%	0.7	S	S	*	*	S	Bend	trans	-85.9	-37.4	-179.6	0	0	0	0	0	116.8
5	A	36.5	Very low	36.2	Very low	94 Å²	94	124.1 Å²	124.1	78%	0.777	68%	0.678	S	S	*	*	H	α-helix	trans	-88.8	-9.3	-166.5	0	0	0	0	0	115.3
6	L	34.4	Very low	36.2	Very low	127 Å²	127	121.9 Å²	121.9	67%	0.665	67%	0.673	S	S	*	*	H	α-helix	trans	-94.7	-9.4	-176.2	-90.7	151.9	0	0	0	114.1
7	I	36.5	Very low	36.4	Very low	108 Å²	108	119.6 Å²	119.6	55%	0.554	66%	0.663	S	S	*	*	H	α-helix	trans	-91.3	-37.4	-176.7	-60.6	171.2	0	0	0	111.1	S9 R10 L11	I7-S9 PolarHBondContact O-N 2.88Å; I7-R10 PolarHBondContact O-N 3.2Å; I7-L11 HydrophobicContact CG2-CD1 4.04Å; I7-L11 PolarHBondContact O-N 3.47Å
8	G	34.2	Very low	36.7	Very low	47 Å²	47	122.4 Å²	122.4	49%	0.485	66%	0.664	S	S	.	*	H	α-helix	trans	-67.2	-34.2	178.7	0	0	0	0	0	114.3	W12	G8-W12 PolarHBondContact O-N 3.41Å
9	S	39.5	Very low	37.1	Very low	66 Å²	66	122 Å²	122	46%	0.462	66%	0.66	S	S	.	*	H	α-helix	trans	-77.6	-25.3	179.5	49.1	0	0	0	0	113.5	I7 K13	I7-S9 PolarHBondContact O-N 2.88Å; S9-K13 PolarHBondContact O-N 3.36Å
10	R	34.3	Very low	37.3	Very low	184 Å²	184	122.3 Å²	122.3	69%	0.694	66%	0.656	S	S	*	*	H	α-helix	trans	-78.1	-37.3	173.8	-85.4	-176.7	175.5	-170.2	-0.5	112.8	I7 Q14	I7-R10 PolarHBondContact O-N 3.2Å; R10-Q14 WeakPolarHBondContact O-CG 3.38Å; R10-Q14 PolarHBondContact O-N 3.27Å; R10-Q14 VanDerWaalsContact O-N 3.11Å
11	L	36.5	Very low	37.5	Very low	112 Å²	112	120.5 Å²	120.5	59%	0.586	65%	0.65	S	S	*	*	H	α-helix	trans	-71.9	-33.5	177.2	-80.1	159.2	0	0	0	112.8	I7 Q14 G15	I7-L11 HydrophobicContact CG2-CD1 4.04Å; I7-L11 PolarHBondContact O-N 3.47Å; L11-Q14 PolarHBondContact O-N 2.97Å; L11-G15 PolarHBondContact O-N 3.15Å
12	W	37.1	Very low	37.8	Very low	215 Å²	215	117.6 Å²	117.6	81%	0.814	63%	0.626	S	S	*	*	H	α-helix	trans	-67.4	-39.8	173.2	-107.4	54.9	0	0	0	113.2	G8 C16	G8-W12 PolarHBondContact O-N 3.41Å; W12-C16 PolarHBondContact O-N 3.48Å
13	K	37.5	Very low	37.9	Very low	167 Å²	167	118.1 Å²	118.1	73%	0.726	62%	0.619	S	S	*	*	H	α-helix	trans	-69.8	-34.1	175.6	-84	-175.2	175.4	-178.1	0	112.9	S9 T17	S9-K13 PolarHBondContact O-N 3.36Å; K13-T17 PolarHBondContact O-N 3.37Å; K13-T17 PolarHBondContact O-OG1 3.43Å
14	Q	38.5	Very low	38.6	Very low	130 Å²	130	115 Å²	115	61%	0.607	61%	0.605	S	S	*	*	H	α-helix	trans	-75.6	-33.8	177.1	-74.9	-178.2	-7.9	0	0	113.1	R10 L11 T17 Y18	R10-Q14 WeakPolarHBondContact O-CG 3.38Å; R10-Q14 PolarHBondContact O-N 3.27Å; R10-Q14 VanDerWaalsContact O-N 3.11Å; L11-Q14 PolarHBondContact O-N 2.97Å; Q14-T17 WeakPolarHBondContact CA-OG1 3.44Å; Q14-T17 PolarHBondContact O-OG1 2.98Å; Q14-Y18 PolarHBondContact O-N 3.28Å
15	G	39.3	Very low	38.9	Very low	36 Å²	36	120.9 Å²	120.9	37%	0.371	61%	0.607	S	S	.	*	H	α-helix	trans	-68.1	-43.5	175.3	0	0	0	0	0	113.8	L11 Y18 I19	L11-G15 PolarHBondContact O-N 3.15Å; G15-Y18 PolarHBondContact O-N 3.4Å; G15-I19 PolarHBondContact O-N 3.13Å
16	C	36.4	Very low	39.2	Very low	89 Å²	89	121.7 Å²	121.7	60%	0.601	60%	0.598	S	S	*	*	H	α-helix	trans	-71.3	-31.6	178.5	-87.8	0	0	0	0	113.6	W12 H20	W12-C16 PolarHBondContact O-N 3.48Å; C16-H20 PolarHBondContact O-N 3.43Å
17	T	40.8	Very low	39.5	Very low	83 Å²	83	121.2 Å²	121.2	51%	0.509	60%	0.604	S	S	.	*	H	α-helix	trans	-73.6	-31.2	175.9	33.2	0	0	0	0	112.6	K13 Q14 T21	K13-T17 PolarHBondContact O-N 3.37Å; K13-T17 PolarHBondContact O-OG1 3.43Å; Q14-T17 WeakPolarHBondContact CA-OG1 3.44Å; Q14-T17 PolarHBondContact O-OG1 2.98Å; T17-T21 WeakPolarHBondContact O-CB 3.31Å; T17-T21 PolarHBondContact O-N 3.43Å; T17-T21 VanDerWaalsContact O-N 3.15Å; T17-T21 PolarHBondContact O-OG1 3.4Å
18	Y	40.5	Very low	39.9	Very low	171 Å²	171	126.7 Å²	126.7	67%	0.671	62%	0.617	S	S	*	*	H	α-helix	trans	-69.1	-35.4	178	-140.9	-94.9	0	0	0	112.9	Q14 G15 R22	Q14-Y18 PolarHBondContact O-N 3.28Å; G15-Y18 PolarHBondContact O-N 3.4Å; Y18-R22 PolarHBondContact O-N 2.68Å
19	I	44.4	Very low	40.3	Very low	114 Å²	114	135 Å²	135	59%	0.585	63%	0.634	S	S	*	*	H	α-helix	trans	-73.7	-40.2	177.7	-61.3	168.7	0	0	0	110.8	G15 T21 L23	G15-I19 PolarHBondContact O-N 3.13Å; I19-T21 PolarHBondContact O-N 3.18Å; I19-L23 HydrophobicContact CG2-CD1 4Å; I19-L23 PolarHBondContact O-N 3.4Å
20	H	40.7	Very low	40.6	Very low	127 Å²	127	139 Å²	139	59%	0.588	65%	0.649	S	S	*	*	H	α-helix	trans	-70.5	-32.3	-178.2	-147	-36.3	0	0	0	113	C16 I24	C16-H20 PolarHBondContact O-N 3.43Å; H20-I24 VanDerWaalsContact ND1-CD1 3.28Å; H20-I24 WeakPolarHBondContact ND1-CD1 3.42Å; H20-I24 WeakPolarHBondContact O-CD1 3.4Å; H20-I24 VanDerWaalsContact O-CG1 3.31Å; H20-I24 WeakPolarHBondContact O-CG1 3.47Å; H20-I24 PolarHBondContact O-N 2.93Å
21	T	42.7	Very low	41.1	Very low	86 Å²	86	136 Å²	136	53%	0.528	65%	0.653	S	S	.	*	H	α-helix	trans	-79.3	-31.3	-177.1	-43.7	0	0	0	0	112.4	T17 I19 Y25	T17-T21 WeakPolarHBondContact O-CB 3.31Å; T17-T21 PolarHBondContact O-N 3.43Å; T17-T21 VanDerWaalsContact O-N 3.15Å; T17-T21 PolarHBondContact O-OG1 3.4Å; I19-T21 PolarHBondContact O-N 3.18Å; T21-Y25 PolarHBondContact O-N 2.8Å
22	R	40.8	Very low	41.9	Very low	179 Å²	179	143 Å²	143	68%	0.675	67%	0.672	S	S	*	*	H	α-helix	trans	-79.2	-33.7	179.1	-126.5	176.2	-179.7	-173	0.2	113.3	Y18	Y18-R22 PolarHBondContact O-N 2.68Å
23	L	41	Very low	42.3	Very low	117 Å²	117	135.3 Å²	135.3	61%	0.613	66%	0.66	S	S	*	*	H	α-helix	trans	-70.7	-33.6	175.6	-103.3	124.5	0	0	0	112.9	I19	I19-L23 HydrophobicContact CG2-CD1 4Å; I19-L23 PolarHBondContact O-N 3.4Å
24	I	45.6	Very low	42.8	Very low	93 Å²	93	138.3 Å²	138.3	48%	0.477	67%	0.668	S	S	.	*	H	α-helix	trans	-74.8	-36.4	178.4	-67	172.5	0	0	0	111.6	H20 L26 C27	H20-I24 VanDerWaalsContact ND1-CD1 3.28Å; H20-I24 WeakPolarHBondContact ND1-CD1 3.42Å; H20-I24 WeakPolarHBondContact O-CD1 3.4Å; H20-I24 VanDerWaalsContact O-CG1 3.31Å; H20-I24 WeakPolarHBondContact O-CG1 3.47Å; H20-I24 PolarHBondContact O-N 2.93Å; I24-L26 VanDerWaalsContact C-N 3.33Å; I24-L26 PolarHBondContact O-N 3.34Å; I24-C27 PolarHBondContact O-N 3.19Å
25	Y	40.5	Very low	43.2	Very low	193 Å²	193	138.6 Å²	138.6	76%	0.757	67%	0.672	S	S	*	*	H	α-helix	trans	-70.7	-25.8	-179	-114.1	-92.7	0	0	0	114	T21	T21-Y25 PolarHBondContact O-N 2.8Å
26	L	42.3	Very low	43.3	Very low	111 Å²	111	142.6 Å²	142.6	58%	0.581	68%	0.679	S	S	*	*	H	α-helix	trans	-79.8	-16.2	176.9	-92.6	151	0	0	0	113.8	I24	I24-L26 VanDerWaalsContact C-N 3.33Å; I24-L26 PolarHBondContact O-N 3.34Å
27	C	41.5	Very low	43.8	Very low	117 Å²	117	147.5 Å²	147.5	79%	0.791	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-4	-176.5	-110.9	0	0	0	0	114.8	I24	I24-C27 PolarHBondContact O-N 3.19Å
28	R	43.5	Very low	44.2	Very low	224 Å²	224	151.1 Å²	151.1	85%	0.845	70%	0.696	S	S	*	*	S	Bend	trans	-110.3	8.8	-169.6	-113	178.9	174.5	169.6	-1.6	116.6
29	R	43.2	Very low	44.8	Very low	220 Å²	220	150 Å²	150	83%	0.83	70%	0.695	S	S	*	*	S	Bend	trans	-140.2	90.4	175.7	-112.4	-178.3	176.3	172.2	-1.3	114
30	I	45.2	Very low	45.2	Very low	152 Å²	152	149.2 Å²	149.2	78%	0.779	69%	0.69	S	S	*	*			trans	66.2	168.5	144.2	-39.3	164.4	0	0	0	117.2
31	P	45.3	Very low	45.9	Very low	121 Å²	121	149.3 Å²	149.3	79%	0.786	69%	0.691	S	S	*	*				-95.4	176.6	-84.5	34.1	-15.1	0	0	0	115.1
32	R	53.5	Low	47.1	Very low	258 Å²	258	148.1 Å²	148.1	97%	0.974	69%	0.685	S	S	*	*			trans	-59.6	131.2	-177.8	-66.3	175.6	-179.6	166.2	-0.1	113.8
33	G	44.9	Very low	48.3	Very low	54 Å²	54	143.1 Å²	143.1	56%	0.557	68%	0.675	S	S	*	*			trans	-171.5	133	167.1	0	0	0	0	0	113.3	I35 F36	G33-I35 PolarHBondContact O-N 3.06Å; G33-I35 VanDerWaalsContact O-N 3.08Å; G33-F36 PolarHBondContact O-N 3.16Å
34	Y	47.3	Very low	49.7	Very low	229 Å²	229	140.4 Å²	140.4	90%	0.898	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.9	-16.3	-172.7	-96.1	-100.6	0	0	0	115.7	F36	Y34-F36 VanDerWaalsContact C-N 3.27Å; Y34-F36 PolarHBondContact O-N 2.98Å
35	I	47	Very low	50.8	Low	136 Å²	136	144.2 Å²	144.2	70%	0.697	68%	0.678	S	S	*	*	H	α-helix	trans	-73.3	-17.1	-177.8	-60.2	174.1	0	0	0	112.4	G33	G33-I35 PolarHBondContact O-N 3.06Å; G33-I35 VanDerWaalsContact O-N 3.08Å
36	F	42.8	Very low	52.2	Low	120 Å²	120	141.2 Å²	141.2	53%	0.526	67%	0.67	S	S	.	*	H	α-helix	trans	-79.2	-25.1	-175.4	-150.2	-101.8	0	0	0	113.9	G33 Y34 M40	G33-F36 PolarHBondContact O-N 3.16Å; Y34-F36 VanDerWaalsContact C-N 3.27Å; Y34-F36 PolarHBondContact O-N 2.98Å; F36-M40 HydrophobicContact CD1-CE 4.38Å; F36-M40 HydrophobicContact CD1-CG 4.11Å; F36-M40 HydrophobicContact CD1-SD 3.99Å; F36-M40 HydrophobicContact CE1-CE 3.59Å; F36-M40 HydrophobicContact CE1-CG 3.98Å; F36-M40 HydrophobicContact CE1-SD 3.8Å; F36-M40 HydrophobicContact CZ-CE 4.44Å; F36-M40 PolarHBondContact O-N 3.45Å
37	R	46.9	Very low	53.5	Low	193 Å²	193	140.9 Å²	140.9	73%	0.728	67%	0.669	S	S	*	*	H	α-helix	trans	-65.6	-45.7	179.3	-98.1	-171.8	174.5	-154.3	-0.4	111.6	K39 M40 H41	R37-K39 PolarHBondContact O-N 3.47Å; R37-M40 PolarHBondContact O-N 3.35Å; R37-H41 WeakPolarHBondContact O-CB 3.43Å; R37-H41 PolarHBondContact O-CD2 2.93Å; R37-H41 PolarHBondContact O-N 3.1Å
38	E	49.2	Very low	54.9	Low	158 Å²	158	140.7 Å²	140.7	74%	0.738	66%	0.66	S	S	*	*	H	α-helix	trans	-63.5	-40.1	-177.6	-72.5	-170.8	152.9	0	0	113	H41 S42	E38-H41 PolarHBondContact O-N 2.92Å; E38-S42 PolarHBondContact O-N 3.22Å
39	K	52.5	Low	56.3	Low	149 Å²	149	135.1 Å²	135.1	65%	0.648	64%	0.643	S	S	*	*	H	α-helix	trans	-70.6	-34.5	177.2	-76.4	-176.4	176.4	-180	0	113.4	R37 S42 V43	R37-K39 PolarHBondContact O-N 3.47Å; K39-S42 PolarHBondContact O-N 2.72Å; K39-S42 PolarHBondContact O-OG 3.06Å; K39-V43 VanDerWaalsContact O-CG2 3.28Å; K39-V43 WeakPolarHBondContact O-CG2 3.34Å; K39-V43 PolarHBondContact O-N 3.5Å; K39-V43 VanDerWaalsContact O-N 3.08Å
40	M	52.6	Low	57.6	Low	96 Å²	96	127.5 Å²	127.5	47%	0.473	63%	0.627	S	S	.	*	H	α-helix	trans	-69.6	-37.8	172.5	-87.2	-166.4	156	0	0	111.9	F36 R37 A44	F36-M40 HydrophobicContact CD1-CE 4.38Å; F36-M40 HydrophobicContact CD1-CG 4.11Å; F36-M40 HydrophobicContact CD1-SD 3.99Å; F36-M40 HydrophobicContact CE1-CE 3.59Å; F36-M40 HydrophobicContact CE1-CG 3.98Å; F36-M40 HydrophobicContact CE1-SD 3.8Å; F36-M40 HydrophobicContact CZ-CE 4.44Å; F36-M40 PolarHBondContact O-N 3.45Å; R37-M40 PolarHBondContact O-N 3.35Å; M40-A44 VanDerWaalsContact O-CB 3.27Å; M40-A44 WeakPolarHBondContact O-CB 3.31Å; M40-A44 PolarHBondContact O-N 3.44Å
41	H	56.3	Low	58.7	Low	130 Å²	130	127.4 Å²	127.4	60%	0.602	62%	0.618	S	S	*	*	H	α-helix	trans	-66	-36.8	174.3	-85.4	-98.6	0	0	0	112	R37 E38 R45	R37-H41 WeakPolarHBondContact O-CB 3.43Å; R37-H41 PolarHBondContact O-CD2 2.93Å; R37-H41 PolarHBondContact O-N 3.1Å; E38-H41 PolarHBondContact O-N 2.92Å; H41-R45 WeakPolarHBondContact O-CB 3.43Å; H41-R45 PolarHBondContact O-N 3.32Å
42	S	67.3	Low	59.8	Low	60 Å²	60	125.9 Å²	125.9	42%	0.42	60%	0.603	S	S	.	*	H	α-helix	trans	-67.8	-45	175.9	74.1	0	0	0	0	111.9	E38 K39 R45 E46	E38-S42 PolarHBondContact O-N 3.22Å; K39-S42 PolarHBondContact O-N 2.72Å; K39-S42 PolarHBondContact O-OG 3.06Å; S42-R45 PolarHBondContact O-N 3.38Å; S42-E46 WeakPolarHBondContact O-CB 3.44Å; S42-E46 PolarHBondContact O-N 2.89Å
43	V	67.1	Low	60.5	Low	74 Å²	74	119.3 Å²	119.3	45%	0.448	58%	0.583	S	S	.	*	H	α-helix	trans	-67.1	-39.5	178.4	173.2	0	0	0	0	111.7	K39 R45 E46 N47	K39-V43 VanDerWaalsContact O-CG2 3.28Å; K39-V43 WeakPolarHBondContact O-CG2 3.34Å; K39-V43 PolarHBondContact O-N 3.5Å; K39-V43 VanDerWaalsContact O-N 3.08Å; V43-R45 VanDerWaalsContact C-N 3.33Å; V43-E46 PolarHBondContact O-N 3.04Å; V43-N47 WeakPolarHBondContact O-CB 3.32Å; V43-N47 VanDerWaalsContact O-CG 3.25Å; V43-N47 PolarHBondContact O-N 3.32Å; V43-N47 PolarHBondContact O-ND2 3.23Å; V43-N47 VanDerWaalsContact O-ND2 3.14Å
44	A	68.9	Low	61.4	Low	60 Å²	60	119.7 Å²	119.7	50%	0.496	58%	0.578	S	S	.	*	H	α-helix	trans	-63.7	-40.5	173.8	0	0	0	0	0	111.6	M40 L48	M40-A44 VanDerWaalsContact O-CB 3.27Å; M40-A44 WeakPolarHBondContact O-CB 3.31Å; M40-A44 PolarHBondContact O-N 3.44Å; A44-L48 WeakPolarHBondContact O-CB 3.41Å; A44-L48 PolarHBondContact O-N 3.05Å
45	R	70.1	Confident	62.1	Low	174 Å²	174	115 Å²	115	66%	0.657	56%	0.559	S	S	*	*	H	α-helix	trans	-66	-41.8	177.3	-171.5	179.1	-179.4	105.3	-2	111.9	H41 S42 V43 L48 Q49	H41-R45 WeakPolarHBondContact O-CB 3.43Å; H41-R45 PolarHBondContact O-N 3.32Å; S42-R45 PolarHBondContact O-N 3.38Å; V43-R45 VanDerWaalsContact C-N 3.33Å; R45-L48 PolarHBondContact O-N 3.2Å; R45-Q49 WeakPolarHBondContact O-CB 3.47Å; R45-Q49 VanDerWaalsContact O-CG 3.26Å; R45-Q49 WeakPolarHBondContact O-CG 3.32Å; R45-Q49 PolarHBondContact O-N 2.86Å
46	E	68.8	Low	62.8	Low	129 Å²	129	115.9 Å²	115.9	60%	0.603	56%	0.558	S	S	*	*	H	α-helix	trans	-68.2	-41.3	179	-160.9	171.4	-153.6	0	0	111.5	S42 V43 L48 Q49 A50	S42-E46 WeakPolarHBondContact O-CB 3.44Å; S42-E46 PolarHBondContact O-N 2.89Å; V43-E46 PolarHBondContact O-N 3.04Å; E46-L48 PolarHBondContact O-N 3.38Å; E46-Q49 PolarHBondContact O-N 2.9Å; E46-A50 WeakPolarHBondContact O-CB 3.12Å; E46-A50 PolarHBondContact O-N 3.15Å
47	N	70.8	Confident	63.5	Low	105 Å²	105	115 Å²	115	56%	0.561	56%	0.558	S	S	*	*	H	α-helix	trans	-63.9	-39.5	172.4	-73.7	-31.1	0	0	0	112.3	V43 A50 Y51	V43-N47 WeakPolarHBondContact O-CB 3.32Å; V43-N47 VanDerWaalsContact O-CG 3.25Å; V43-N47 PolarHBondContact O-N 3.32Å; V43-N47 PolarHBondContact O-ND2 3.23Å; V43-N47 VanDerWaalsContact O-ND2 3.14Å; N47-A50 PolarHBondContact O-N 3.44Å; N47-Y51 WeakPolarHBondContact O-CB 2.97Å; N47-Y51 PolarHBondContact O-N 3.37Å
48	L	70.2	Confident	63.9	Low	112 Å²	112	108.7 Å²	108.7	59%	0.586	54%	0.543	S	S	*	.	H	α-helix	trans	-67.1	-39.2	175.9	-153	101.1	0	0	0	111.1	A44 R45 E46 Y51 L52	A44-L48 WeakPolarHBondContact O-CB 3.41Å; A44-L48 PolarHBondContact O-N 3.05Å; R45-L48 PolarHBondContact O-N 3.2Å; E46-L48 PolarHBondContact O-N 3.38Å; L48-Y51 PolarHBondContact O-N 2.55Å; L48-L52 HydrophobicContact CD2-CD1 4.04Å; L48-L52 HydrophobicContact CG-CD1 4.47Å; L48-L52 WeakPolarHBondContact O-CB 3.11Å; L48-L52 VanDerWaalsContact O-CG 3.22Å; L48-L52 WeakPolarHBondContact O-CG 2.97Å; L48-L52 PolarHBondContact O-N 3.45Å
49	Q	72.6	Confident	64	Low	107 Å²	107	105 Å²	105	50%	0.5	54%	0.535	S	S	.	.	H	α-helix	trans	-65.7	-42.6	175.3	-77.9	174.2	-22.3	0	0	111.8	R45 E46 Y51 L52 H53	R45-Q49 WeakPolarHBondContact O-CB 3.47Å; R45-Q49 VanDerWaalsContact O-CG 3.26Å; R45-Q49 WeakPolarHBondContact O-CG 3.32Å; R45-Q49 PolarHBondContact O-N 2.86Å; E46-Q49 PolarHBondContact O-N 2.9Å; Q49-Y51 VanDerWaalsContact C-N 3.32Å; Q49-Y51 PolarHBondContact O-N 3.2Å; Q49-L52 PolarHBondContact O-N 3.2Å; Q49-H53 WeakPolarHBondContact O-CB 3.46Å; Q49-H53 PolarHBondContact O-N 3.18Å
50	A	69.9	Low	64.1	Low	60 Å²	60	104.7 Å²	104.7	50%	0.496	54%	0.541	S	S	.	.	H	α-helix	trans	-62.6	-39.6	175	0	0	0	0	0	111.8	E46 N47 S54	E46-A50 WeakPolarHBondContact O-CB 3.12Å; E46-A50 PolarHBondContact O-N 3.15Å; N47-A50 PolarHBondContact O-N 3.44Å; A50-S54 WeakPolarHBondContact O-CB 3.34Å; A50-S54 PolarHBondContact O-N 3.42Å; A50-S54 PolarHBondContact O-OG 2.94Å
51	Y	69	Low	64.1	Low	150 Å²	150	106.2 Å²	106.2	59%	0.588	55%	0.547	S	S	*	.	H	α-helix	trans	-65.2	-45.2	173.4	-179.6	-95.3	0	0	0	112.5	N47 L48 Q49 H53 S54 Y55	N47-Y51 WeakPolarHBondContact O-CB 2.97Å; N47-Y51 PolarHBondContact O-N 3.37Å; L48-Y51 PolarHBondContact O-N 2.55Å; Q49-Y51 VanDerWaalsContact C-N 3.32Å; Q49-Y51 PolarHBondContact O-N 3.2Å; Y51-H53 VanDerWaalsContact C-N 3.32Å; Y51-H53 PolarHBondContact O-N 3.36Å; Y51-S54 PolarHBondContact O-N 3.49Å; Y51-S54 PolarHBondContact O-OG 3.16Å; Y51-Y55 WeakPolarHBondContact O-CB 3.24Å; Y51-Y55 PolarHBondContact O-N 3.44Å
52	L	69.1	Low	63.9	Low	89 Å²	89	106.7 Å²	106.7	47%	0.466	56%	0.561	S	S	.	*	H	α-helix	trans	-66.9	-34.7	177.5	-72	169.4	0	0	0	112.1	L48 Q49 K56	L48-L52 HydrophobicContact CD2-CD1 4.04Å; L48-L52 HydrophobicContact CG-CD1 4.47Å; L48-L52 WeakPolarHBondContact O-CB 3.11Å; L48-L52 VanDerWaalsContact O-CG 3.22Å; L48-L52 WeakPolarHBondContact O-CG 2.97Å; L48-L52 PolarHBondContact O-N 3.45Å; Q49-L52 PolarHBondContact O-N 3.2Å; L52-K56 WeakPolarHBondContact O-CB 2.96Å; L52-K56 WeakPolarHBondContact O-CG 3.23Å; L52-K56 PolarHBondContact O-N 3.41Å
53	H	68.2	Low	63.3	Low	120 Å²	120	107.4 Å²	107.4	56%	0.556	58%	0.578	S	S	*	*	H	α-helix	trans	-69	-45.5	176.1	-174.7	-103.1	0	0	0	111.3	Q49 Y51 Y55 K56 L57	Q49-H53 WeakPolarHBondContact O-CB 3.46Å; Q49-H53 PolarHBondContact O-N 3.18Å; Y51-H53 VanDerWaalsContact C-N 3.32Å; Y51-H53 PolarHBondContact O-N 3.36Å; H53-Y55 VanDerWaalsContact C-N 3.33Å; H53-Y55 PolarHBondContact O-N 3.11Å; H53-K56 PolarHBondContact O-N 3.48Å; H53-L57 WeakPolarHBondContact CE1-CD1 3.46Å; H53-L57 WeakPolarHBondContact O-CB 3.45Å; H53-L57 WeakPolarHBondContact O-CG 3.14Å; H53-L57 PolarHBondContact O-N 3.24Å
54	S	63.4	Low	62.6	Low	63 Å²	63	109.6 Å²	109.6	44%	0.441	59%	0.586	S	S	.	*	H	α-helix	trans	-65.3	-35.9	175.4	63.9	0	0	0	0	112.4	A50 Y51 L57 S58	A50-S54 WeakPolarHBondContact O-CB 3.34Å; A50-S54 PolarHBondContact O-N 3.42Å; A50-S54 PolarHBondContact O-OG 2.94Å; Y51-S54 PolarHBondContact O-N 3.49Å; Y51-S54 PolarHBondContact O-OG 3.16Å; S54-L57 PolarHBondContact O-N 3.09Å; S54-S58 WeakPolarHBondContact O-CB 3.4Å; S54-S58 PolarHBondContact O-N 3.29Å
55	Y	60.9	Low	61.7	Low	131 Å²	131	115.1 Å²	115.1	51%	0.514	60%	0.599	S	S	.	*	H	α-helix	trans	-65.2	-42.6	173.7	-163.5	-88	0	0	0	112.5	Y51 H53 L57 S58 S59	Y51-Y55 WeakPolarHBondContact O-CB 3.24Å; Y51-Y55 PolarHBondContact O-N 3.44Å; H53-Y55 VanDerWaalsContact C-N 3.33Å; H53-Y55 PolarHBondContact O-N 3.11Å; Y55-L57 VanDerWaalsContact C-N 3.34Å; Y55-S58 PolarHBondContact O-N 2.81Å; Y55-S58 PolarHBondContact O-OG 2.78Å; Y55-S58 VanDerWaalsContact O-OG 3.14Å; Y55-S59 PolarHBondContact O-N 3.04Å; Y55-S59 PolarHBondContact O-OG 2.97Å
56	K	62.7	Low	60.9	Low	154 Å²	154	114.1 Å²	114.1	67%	0.67	61%	0.605	S	S	*	*	H	α-helix	trans	-66.6	-34	175	-82.3	-177.9	177.4	-177.7	0	112.9	L52 H53 S59	L52-K56 WeakPolarHBondContact O-CB 2.96Å; L52-K56 WeakPolarHBondContact O-CG 3.23Å; L52-K56 PolarHBondContact O-N 3.41Å; H53-K56 PolarHBondContact O-N 3.48Å; K56-S59 VanDerWaalsContact C-OG 3.24Å; K56-S59 WeakPolarHBondContact CA-OG 3.42Å; K56-S59 PolarHBondContact O-OG 2.76Å
57	L	57.2	Low	60	Low	102 Å²	102	115 Å²	115	53%	0.534	61%	0.612	S	S	.	*	H	α-helix	trans	-72.2	-39.1	174.8	-73.1	171.2	0	0	0	111.7	H53 S54 Y55 S59 N60	H53-L57 WeakPolarHBondContact CE1-CD1 3.46Å; H53-L57 WeakPolarHBondContact O-CB 3.45Å; H53-L57 WeakPolarHBondContact O-CG 3.14Å; H53-L57 PolarHBondContact O-N 3.24Å; S54-L57 PolarHBondContact O-N 3.09Å; Y55-L57 VanDerWaalsContact C-N 3.34Å; L57-S59 PolarHBondContact O-N 3.47Å; L57-N60 PolarHBondContact O-N 2.98Å; L57-N60 VanDerWaalsContact O-N 3.13Å
58	S	54.8	Low	59.4	Low	59 Å²	59	117.1 Å²	117.1	41%	0.413	62%	0.617	S	S	.	*	H	α-helix	trans	-67.9	-23	177.8	85.1	0	0	0	0	113.1	S54 Y55 N60	S54-S58 WeakPolarHBondContact O-CB 3.4Å; S54-S58 PolarHBondContact O-N 3.29Å; Y55-S58 PolarHBondContact O-N 2.81Å; Y55-S58 PolarHBondContact O-OG 2.78Å; Y55-S58 VanDerWaalsContact O-OG 3.14Å; S58-N60 PolarHBondContact O-N 3.29Å
59	S	52.6	Low	59.1	Low	82 Å²	82	114.4 Å²	114.4	57%	0.573	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-9.7	173	33.5	0	0	0	0	114.7	Y55 K56 L57	Y55-S59 PolarHBondContact O-N 3.04Å; Y55-S59 PolarHBondContact O-OG 2.97Å; K56-S59 VanDerWaalsContact C-OG 3.24Å; K56-S59 WeakPolarHBondContact CA-OG 3.42Å; K56-S59 PolarHBondContact O-OG 2.76Å; L57-S59 PolarHBondContact O-N 3.47Å
60	N	54.3	Low	58.9	Low	142 Å²	142	112.1 Å²	112.1	76%	0.759	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	2.6	178.7	-81.7	-3.8	0	0	0	114.4	L57 S58	L57-N60 PolarHBondContact O-N 2.98Å; L57-N60 VanDerWaalsContact O-N 3.13Å; S58-N60 PolarHBondContact O-N 3.29Å
61	E	52.3	Low	59.1	Low	128 Å²	128	116.5 Å²	116.5	60%	0.598	61%	0.61	S	S	*	*	S	Bend	trans	-85.6	120.6	171	-73.8	-162.1	159.6	0	0	111.1	G63	E61-G63 PolarHBondContact O-N 3.43Å
62	P	51.5	Low	59.3	Low	140 Å²	140	118.2 Å²	118.2	91%	0.909	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	95.7	177	28.9	-31.6	0	0	0	109.6
63	G	54.3	Low	59.6	Low	74 Å²	74	117.6 Å²	117.6	76%	0.763	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	153.3	-19.8	171	0	0	0	0	0	116.3	E61	E61-G63 PolarHBondContact O-N 3.43Å
64	I	53.3	Low	60.1	Low	121 Å²	121	115.3 Å²	115.3	62%	0.621	60%	0.604	S	S	*	*			trans	-126.4	60.2	-179.7	-44.7	178.9	0	0	0	109.9	L66	I64-L66 PolarHBondContact O-N 2.65Å
65	K	49.2	Very low	61	Low	176 Å²	176	117 Å²	117	77%	0.765	61%	0.605	S	S	*	*			trans	-78.8	107	163.8	-153.4	171.9	-172.5	178.2	0	106.4	M67	K65-M67 HydrophobicContact CB-CG 4.25Å; K65-M67 HydrophobicContact CD-SD 4.07Å; K65-M67 HydrophobicContact CG-CG 4.43Å; K65-M67 HydrophobicContact CG-SD 4.41Å; K65-M67 PolarHBondContact O-N 3.47Å
66	L	54	Low	62	Low	152 Å²	152	116.4 Å²	116.4	80%	0.796	61%	0.607	S	S	*	*			trans	-61.8	85.8	163.4	-83.7	162.7	0	0	0	107.1	I64 H68	I64-L66 PolarHBondContact O-N 2.65Å; L66-H68 VanDerWaalsContact C-N 3.27Å; L66-H68 PolarHBondContact O-N 2.9Å
67	M	50.7	Low	62.9	Low	149 Å²	149	117.2 Å²	117.2	73%	0.734	61%	0.606	S	S	*	*			trans	-71.1	90.3	174.5	-64.3	-94.7	-72.6	0	0	105.9	K65 N69	K65-M67 HydrophobicContact CB-CG 4.25Å; K65-M67 HydrophobicContact CD-SD 4.07Å; K65-M67 HydrophobicContact CG-CG 4.43Å; K65-M67 HydrophobicContact CG-SD 4.41Å; K65-M67 PolarHBondContact O-N 3.47Å; M67-N69 VanDerWaalsContact C-N 3.25Å; M67-N69 PolarHBondContact O-N 3.08Å
68	H	56.3	Low	64.2	Low	148 Å²	148	118.6 Å²	118.6	69%	0.685	61%	0.607	S	S	*	*			trans	-62.4	96.3	166.3	179	54.6	0	0	0	107	L66 S70 D73	L66-H68 VanDerWaalsContact C-N 3.27Å; L66-H68 PolarHBondContact O-N 2.9Å; H68-S70 VanDerWaalsContact C-N 3.33Å; H68-S70 PolarHBondContact O-N 2.81Å; H68-D73 IonicContact CE1-OD2 3.55Å; H68-D73 PolarHBondContact CE1-OD2 2.81Å; H68-D73 IonicContact ND1-OD2 3.22Å; H68-D73 PolarHBondContact ND1-OD2 3.29Å
69	N	64	Low	65.7	Low	55 Å²	55	118.9 Å²	118.9	29%	0.294	60%	0.604	S	S	.	*			trans	-88.9	83.1	178	-171.3	-18.7	0	0	0	107.1	M67 Q71 R72 D73	M67-N69 VanDerWaalsContact C-N 3.25Å; M67-N69 PolarHBondContact O-N 3.08Å; N69-Q71 PolarHBondContact O-N 3.36Å; N69-Q71 PolarHBondContact OD1-N 3.08Å; N69-R72 HydrophobicContact CB-CB 4.15Å; N69-R72 HydrophobicContact CB-CG 4.3Å; N69-R72 WeakPolarHBondContact ND2-CD 3.47Å; N69-R72 WeakPolarHBondContact ND2-CG 3.46Å; N69-R72 PolarHBondContact ND2-NE 3.16Å; N69-R72 PolarHBondContact O-N 3.44Å; N69-R72 PolarHBondContact OD1-N 3.37Å; N69-D73 PolarHBondContact O-N 2.99Å; N69-D73 VanDerWaalsContact O-N 3.07Å
70	S	69.8	Low	67.4	Low	59 Å²	59	118.8 Å²	118.8	41%	0.413	60%	0.6	S	S	.	*	H	α-helix	trans	-47.8	-37.2	180	53.2	0	0	0	0	112.4	H68 D73 D74	H68-S70 VanDerWaalsContact C-N 3.33Å; H68-S70 PolarHBondContact O-N 2.81Å; S70-D73 PolarHBondContact O-N 3.15Å; S70-D74 VanDerWaalsContact O-CB 3.27Å; S70-D74 WeakPolarHBondContact O-CB 3.24Å; S70-D74 PolarHBondContact O-N 2.8Å
71	Q	73.9	Confident	69	Low	152 Å²	152	116.1 Å²	116.1	71%	0.71	58%	0.583	S	S	*	*	H	α-helix	trans	-66.7	-39.8	178.5	-63.4	179	-35.1	0	0	113.2	N69 Q75	N69-Q71 PolarHBondContact O-N 3.36Å; N69-Q71 PolarHBondContact OD1-N 3.08Å; Q71-Q75 WeakPolarHBondContact O-CB 3.43Å; Q71-Q75 PolarHBondContact O-N 3.26Å
72	R	73.9	Confident	70.9	Confident	186 Å²	186	114 Å²	114	70%	0.702	57%	0.573	S	S	*	*	H	α-helix	trans	-70.6	-39.8	176.5	-76.3	-177.4	-178	178.6	0	111.5	N69 Q75 H76	N69-R72 HydrophobicContact CB-CB 4.15Å; N69-R72 HydrophobicContact CB-CG 4.3Å; N69-R72 WeakPolarHBondContact ND2-CD 3.47Å; N69-R72 WeakPolarHBondContact ND2-CG 3.46Å; N69-R72 PolarHBondContact ND2-NE 3.16Å; N69-R72 PolarHBondContact O-N 3.44Å; N69-R72 PolarHBondContact OD1-N 3.37Å; R72-Q75 PolarHBondContact O-N 3.23Å; R72-H76 WeakPolarHBondContact O-CB 3.02Å; R72-H76 PolarHBondContact O-N 3.45Å
73	D	75.4	Confident	72.8	Confident	77 Å²	77	113.7 Å²	113.7	41%	0.412	56%	0.558	S	S	.	*	H	α-helix	trans	-66.1	-40.7	177.1	-66.7	-20.3	0	0	0	110.7	H68 N69 S70 H76 R77	H68-D73 IonicContact CE1-OD2 3.55Å; H68-D73 PolarHBondContact CE1-OD2 2.81Å; H68-D73 IonicContact ND1-OD2 3.22Å; H68-D73 PolarHBondContact ND1-OD2 3.29Å; N69-D73 PolarHBondContact O-N 2.99Å; N69-D73 VanDerWaalsContact O-N 3.07Å; S70-D73 PolarHBondContact O-N 3.15Å; D73-H76 PolarHBondContact O-N 3.31Å; D73-R77 VanDerWaalsContact O-CG 3.22Å; D73-R77 WeakPolarHBondContact O-CG 3.48Å; D73-R77 PolarHBondContact O-N 3.32Å
74	D	77.9	Confident	74.7	Confident	72 Å²	72	112.4 Å²	112.4	39%	0.385	54%	0.539	S	S	.	.	H	α-helix	trans	-68.2	-40.1	175.5	-74.4	-27	0	0	0	112.5	S70 R77 K78	S70-D74 VanDerWaalsContact O-CB 3.27Å; S70-D74 WeakPolarHBondContact O-CB 3.24Å; S70-D74 PolarHBondContact O-N 2.8Å; D74-R77 PolarHBondContact O-N 3.4Å; D74-R77 IonicContact OD1-NH1 3.06Å; D74-R77 PolarHBondContact OD1-NH1 2.83Å; D74-K78 WeakPolarHBondContact O-CG 3.29Å; D74-K78 PolarHBondContact O-N 3.22Å
75	Q	81.4	Confident	76.7	Confident	97 Å²	97	106.6 Å²	106.6	45%	0.453	51%	0.51	S	S	.	.	H	α-helix	trans	-63.3	-45.2	174.4	-172.6	60.3	43.2	0	0	111.1	Q71 R72 R77 K78 D79	Q71-Q75 WeakPolarHBondContact O-CB 3.43Å; Q71-Q75 PolarHBondContact O-N 3.26Å; R72-Q75 PolarHBondContact O-N 3.23Å; Q75-R77 VanDerWaalsContact C-N 3.3Å; Q75-R77 PolarHBondContact O-N 2.93Å; Q75-K78 WeakPolarHBondContact O-CB 3.11Å; Q75-K78 PolarHBondContact O-N 3.43Å; Q75-K78 VanDerWaalsContact O-N 3.15Å; Q75-D79 PolarHBondContact NE2-OD1 2.95Å; Q75-D79 PolarHBondContact O-N 3.21Å
76	H	82	Confident	78.9	Confident	120 Å²	120	101.1 Å²	101.1	56%	0.556	49%	0.489	S	S	*	.	H	α-helix	trans	-60	-41	176.9	-177.6	61.7	0	0	0	112	R72 D73 D79 V80	R72-H76 WeakPolarHBondContact O-CB 3.02Å; R72-H76 PolarHBondContact O-N 3.45Å; D73-H76 PolarHBondContact O-N 3.31Å; H76-D79 PolarHBondContact O-N 3.16Å; H76-V80 VanDerWaalsContact O-CG2 3.28Å; H76-V80 WeakPolarHBondContact O-CG2 3.28Å; H76-V80 PolarHBondContact O-N 3.48Å
77	R	82.1	Confident	80.8	Confident	170 Å²	170	103.1 Å²	103.1	64%	0.642	49%	0.485	S	S	*	.	H	α-helix	trans	-61.5	-44	175.1	-73.2	169.3	66.1	-161	2.7	111.9	D73 D74 Q75 V80 E81	D73-R77 VanDerWaalsContact O-CG 3.22Å; D73-R77 WeakPolarHBondContact O-CG 3.48Å; D73-R77 PolarHBondContact O-N 3.32Å; D74-R77 PolarHBondContact O-N 3.4Å; D74-R77 IonicContact OD1-NH1 3.06Å; D74-R77 PolarHBondContact OD1-NH1 2.83Å; Q75-R77 VanDerWaalsContact C-N 3.3Å; Q75-R77 PolarHBondContact O-N 2.93Å; R77-V80 PolarHBondContact O-N 3.27Å; R77-E81 WeakPolarHBondContact O-CB 3.24Å; R77-E81 PolarHBondContact O-N 2.95Å
78	K	84	Confident	82.9	Confident	131 Å²	131	97.2 Å²	97.2	57%	0.57	46%	0.46	S	S	*	.	H	α-helix	trans	-62	-43.2	175.8	-72	176.3	-177.5	-177	0	111.7	D74 Q75 E81 H82	D74-K78 WeakPolarHBondContact O-CG 3.29Å; D74-K78 PolarHBondContact O-N 3.22Å; Q75-K78 WeakPolarHBondContact O-CB 3.11Å; Q75-K78 PolarHBondContact O-N 3.43Å; Q75-K78 VanDerWaalsContact O-N 3.15Å; K78-E81 PolarHBondContact O-N 3.07Å; K78-H82 VanDerWaalsContact O-CB 3.26Å; K78-H82 WeakPolarHBondContact O-CB 3.37Å; K78-H82 PolarHBondContact O-N 3.47Å
79	D	86.7	Confident	84.8	Confident	65 Å²	65	90.2 Å²	90.2	35%	0.348	43%	0.428	S	S	.	.	H	α-helix	trans	-63.7	-45	178.7	-62.5	-18.4	0	0	0	110.9	Q75 H76 E81 H82 F83	Q75-D79 PolarHBondContact NE2-OD1 2.95Å; Q75-D79 PolarHBondContact O-N 3.21Å; H76-D79 PolarHBondContact O-N 3.16Å; D79-E81 PolarHBondContact O-N 3.33Å; D79-H82 WeakPolarHBondContact O-CB 3.4Å; D79-H82 PolarHBondContact O-N 3.48Å; D79-F83 HydrophobicContact CB-CE2 4.47Å; D79-F83 WeakPolarHBondContact O-CD2 3.48Å; D79-F83 PolarHBondContact O-N 3.18Å
80	V	88.8	Confident	86.1	Confident	80 Å²	80	92.5 Å²	92.5	49%	0.485	44%	0.437	S	S	.	.	H	α-helix	trans	-60.6	-44.5	176.3	171	0	0	0	0	111.2	H76 R77 A84	H76-V80 VanDerWaalsContact O-CG2 3.28Å; H76-V80 WeakPolarHBondContact O-CG2 3.28Å; H76-V80 PolarHBondContact O-N 3.48Å; R77-V80 PolarHBondContact O-N 3.27Å; V80-A84 VanDerWaalsContact O-CB 3.3Å; V80-A84 WeakPolarHBondContact O-CB 3.5Å; V80-A84 PolarHBondContact O-N 3.49Å
81	E	88.5	Confident	87.3	Confident	87 Å²	87	94.9 Å²	94.9	41%	0.407	44%	0.441	S	S	.	.	H	α-helix	trans	-64.2	-42	176.7	-173.7	167.1	-156.5	0	0	111.6	R77 K78 D79 A84 A85 F136	R77-E81 WeakPolarHBondContact O-CB 3.24Å; R77-E81 PolarHBondContact O-N 2.95Å; K78-E81 PolarHBondContact O-N 3.07Å; D79-E81 PolarHBondContact O-N 3.33Å; E81-A84 PolarHBondContact O-N 3.38Å; E81-A85 VanDerWaalsContact O-CB 3.26Å; E81-A85 WeakPolarHBondContact O-CB 3.48Å; E81-A85 PolarHBondContact O-N 3.2Å; E81-F136 HydrophobicContact CG-CZ 4.33Å
82	H	90.8	Very high	88.3	Confident	83 Å²	83	87.7 Å²	87.7	38%	0.384	41%	0.408	S	S	.	.	H	α-helix	trans	-59.6	-49.1	176.5	179.2	-85.7	0	0	0	112	K78 D79 A84 A85 L86 L117	K78-H82 VanDerWaalsContact O-CB 3.26Å; K78-H82 WeakPolarHBondContact O-CB 3.37Å; K78-H82 PolarHBondContact O-N 3.47Å; D79-H82 WeakPolarHBondContact O-CB 3.4Å; D79-H82 PolarHBondContact O-N 3.48Å; H82-A84 VanDerWaalsContact C-N 3.34Å; H82-A84 PolarHBondContact O-N 3.29Å; H82-A85 WeakPolarHBondContact O-CB 3.44Å; H82-A85 PolarHBondContact O-N 2.78Å; H82-L86 PolarHBondContact O-N 3.11Å; H82-L117 WeakPolarHBondContact CD2-CD2 3.47Å; H82-L117 VanDerWaalsContact NE2-CD2 3.35Å; H82-L117 WeakPolarHBondContact NE2-CD2 3.38Å
83	F	92.2	Very high	89.1	Confident	134 Å²	134	80.8 Å²	80.8	59%	0.588	38%	0.383	S	S	*	.	H	α-helix	trans	-65.6	-36.8	176.4	-73.5	-64.9	0	0	0	112.6	D79 R87	D79-F83 HydrophobicContact CB-CE2 4.47Å; D79-F83 WeakPolarHBondContact O-CD2 3.48Å; D79-F83 PolarHBondContact O-N 3.18Å; F83-R87 WeakPolarHBondContact O-CB 3.41Å; F83-R87 PolarHBondContact O-N 3.13Å; F83-R87 VanDerWaalsContact O-N 3.14Å
84	A	94.3	Very high	89.8	Confident	46 Å²	46	87.8 Å²	87.8	38%	0.38	40%	0.404	S	S	.	.	H	α-helix	trans	-64.7	-41.5	174.8	0	0	0	0	0	111.6	V80 E81 H82 R87 A88	V80-A84 VanDerWaalsContact O-CB 3.3Å; V80-A84 WeakPolarHBondContact O-CB 3.5Å; V80-A84 PolarHBondContact O-N 3.49Å; E81-A84 PolarHBondContact O-N 3.38Å; H82-A84 VanDerWaalsContact C-N 3.34Å; H82-A84 PolarHBondContact O-N 3.29Å; A84-R87 PolarHBondContact O-N 3.36Å; A84-A88 VanDerWaalsContact O-CB 3.31Å; A84-A88 WeakPolarHBondContact O-CB 3.44Å; A84-A88 PolarHBondContact O-N 3.41Å
85	A	94.9	Very high	90.5	Very high	0 Å²	0	88.5 Å²	88.5	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-62	-48.2	177.5	0	0	0	0	0	111.7	E81 H82 R87 A88 L89 P116 L117 F136 F154	E81-A85 VanDerWaalsContact O-CB 3.26Å; E81-A85 WeakPolarHBondContact O-CB 3.48Å; E81-A85 PolarHBondContact O-N 3.2Å; H82-A85 WeakPolarHBondContact O-CB 3.44Å; H82-A85 PolarHBondContact O-N 2.78Å; A85-R87 VanDerWaalsContact C-N 3.35Å; A85-R87 PolarHBondContact O-N 3.17Å; A85-A88 PolarHBondContact O-N 3.36Å; A85-L89 WeakPolarHBondContact O-CB 3.46Å; A85-L89 PolarHBondContact O-N 2.97Å; A85-P116 HydrophobicContact CB-CB 3.81Å; A85-L117 HydrophobicContact CB-CD1 3.73Å; A85-L117 HydrophobicContact CB-CG 3.78Å; A85-F136 HydrophobicContact CB-CE2 4.1Å; A85-F136 HydrophobicContact CB-CZ 3.84Å; A85-F154 HydrophobicContact CB-CE1 4.32Å; A85-F154 HydrophobicContact CB-CE2 4.46Å; A85-F154 HydrophobicContact CB-CZ 3.69Å
86	L	94.6	Very high	91.1	Very high	61 Å²	61	92.1 Å²	92.1	32%	0.319	42%	0.42	S	S	.	.	H	α-helix	trans	-58.2	-46.2	175.9	-75.3	173.7	0	0	0	111.9	H82 A88 L89 Q90 L117	H82-L86 PolarHBondContact O-N 3.11Å; L86-A88 PolarHBondContact O-N 2.92Å; L86-L89 PolarHBondContact O-N 3.21Å; L86-Q90 WeakPolarHBondContact O-CG 3.44Å; L86-Q90 PolarHBondContact O-N 2.87Å; L86-Q90 VanDerWaalsContact O-N 3.07Å; L86-L117 HydrophobicContact CD2-CD1 3.63Å; L86-L117 HydrophobicContact CD2-CD2 4.27Å; L86-L117 HydrophobicContact CG-CD1 3.87Å; L86-L117 HydrophobicContact CG-CD2 4.25Å
87	R	94.6	Very high	91.7	Very high	193 Å²	193	87.4 Å²	87.4	73%	0.728	40%	0.399	S	S	*	.	H	α-helix	trans	-63.1	-43.7	178.4	-172	-172.2	-62.1	173.7	0.9	111.5	F83 A84 A85 L89 Q90 H91	F83-R87 WeakPolarHBondContact O-CB 3.41Å; F83-R87 PolarHBondContact O-N 3.13Å; F83-R87 VanDerWaalsContact O-N 3.14Å; A84-R87 PolarHBondContact O-N 3.36Å; A85-R87 VanDerWaalsContact C-N 3.35Å; A85-R87 PolarHBondContact O-N 3.17Å; R87-L89 VanDerWaalsContact C-N 3.32Å; R87-L89 PolarHBondContact O-N 2.85Å; R87-Q90 PolarHBondContact O-N 2.84Å; R87-H91 WeakPolarHBondContact O-CB 3.45Å; R87-H91 PolarHBondContact O-N 2.72Å
88	A	95.4	Very high	92.4	Very high	25 Å²	25	82.4 Å²	82.4	21%	0.207	39%	0.394	C	S	.	.	H	α-helix	trans	-63.9	-38.6	179.6	0	0	0	0	0	111.8	A84 A85 L86 H91 S92 F136 I142	A84-A88 VanDerWaalsContact O-CB 3.31Å; A84-A88 WeakPolarHBondContact O-CB 3.44Å; A84-A88 PolarHBondContact O-N 3.41Å; A85-A88 PolarHBondContact O-N 3.36Å; L86-A88 PolarHBondContact O-N 2.92Å; A88-H91 PolarHBondContact O-N 3.4Å; A88-S92 WeakPolarHBondContact O-CB 3.33Å; A88-S92 PolarHBondContact O-N 3.07Å; A88-S92 PolarHBondContact O-OG 3.01Å; A88-F136 HydrophobicContact CB-CD2 3.82Å; A88-F136 HydrophobicContact CB-CE2 4.12Å; A88-I142 HydrophobicContact CB-CD1 3.59Å
89	L	94.8	Very high	92.9	Very high	2 Å²	2	79.3 Å²	79.3	1%	0.01	38%	0.381	C	S	.	.	H	α-helix	trans	-64.5	-48.4	176.4	-170	140.5	0	0	0	111.4	A85 L86 R87 H91 S92 K93 H120 F152 F154	A85-L89 WeakPolarHBondContact O-CB 3.46Å; A85-L89 PolarHBondContact O-N 2.97Å; L86-L89 PolarHBondContact O-N 3.21Å; R87-L89 VanDerWaalsContact C-N 3.32Å; R87-L89 PolarHBondContact O-N 2.85Å; L89-H91 PolarHBondContact O-N 3.31Å; L89-S92 PolarHBondContact O-N 3.25Å; L89-K93 PolarHBondContact O-N 2.76Å; L89-H120 HydrophobicContact CD1-CB 3.83Å; L89-F152 HydrophobicContact CD2-CB 4.45Å; L89-F152 HydrophobicContact CG-CB 4.32Å; L89-F154 HydrophobicContact CD1-CD2 4.34Å; L89-F154 HydrophobicContact CD1-CE2 3.74Å; L89-F154 HydrophobicContact CD1-CZ 4.42Å
90	Q	93.2	Very high	93.4	Very high	102 Å²	102	76.3 Å²	76.3	48%	0.477	37%	0.365	S	S	.	.	H	α-helix	trans	-62.7	-41.2	176.9	-66.2	-62.2	-13.6	0	0	112.5	L86 R87 S92 K93	L86-Q90 WeakPolarHBondContact O-CG 3.44Å; L86-Q90 PolarHBondContact O-N 2.87Å; L86-Q90 VanDerWaalsContact O-N 3.07Å; R87-Q90 PolarHBondContact O-N 2.84Å; Q90-S92 VanDerWaalsContact C-N 3.3Å; Q90-S92 PolarHBondContact O-N 3.16Å; Q90-K93 PolarHBondContact O-N 3.31Å
91	H	93.7	Very high	93.8	Very high	109 Å²	109	72.5 Å²	72.5	51%	0.505	34%	0.342	S	S	.	.	H	α-helix	trans	-67.9	-31.2	177.8	-174.9	65.9	0	0	0	112.5	R87 A88 L89 K93 R94 K95	R87-H91 WeakPolarHBondContact O-CB 3.45Å; R87-H91 PolarHBondContact O-N 2.72Å; A88-H91 PolarHBondContact O-N 3.4Å; L89-H91 PolarHBondContact O-N 3.31Å; H91-K93 VanDerWaalsContact C-N 3.31Å; H91-K93 PolarHBondContact O-N 3.42Å; H91-R94 PolarHBondContact O-N 3.46Å; H91-K95 WeakPolarHBondContact CD2-CE 3.33Å; H91-K95 PolarHBondContact CD2-NZ 3.03Å; H91-K95 WeakPolarHBondContact NE2-CE 3.07Å; H91-K95 PolarHBondContact NE2-NZ 3.25Å
92	S	94.3	Very high	94.1	Very high	1 Å²	1	69.6 Å²	69.6	1%	0.007	33%	0.329	C	S	.	.	H	α-helix	trans	-68.8	-26.9	179.4	-63.7	0	0	0	0	113.3	A88 L89 Q90 R94 K95 T134	A88-S92 WeakPolarHBondContact O-CB 3.33Å; A88-S92 PolarHBondContact O-N 3.07Å; A88-S92 PolarHBondContact O-OG 3.01Å; L89-S92 PolarHBondContact O-N 3.25Å; Q90-S92 VanDerWaalsContact C-N 3.3Å; Q90-S92 PolarHBondContact O-N 3.16Å; S92-R94 PolarHBondContact O-N 3.42Å; S92-R94 VanDerWaalsContact O-N 3.1Å; S92-K95 PolarHBondContact O-N 2.82Å; S92-T134 PolarHBondContact OG-OG1 2.86Å
93	K	91.6	Very high	94.3	Very high	42 Å²	42	65.7 Å²	65.7	18%	0.183	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-22.7	176.2	-66.4	178.4	178.8	176.5	0	114	L89 Q90 H91 F152 Y376	L89-K93 PolarHBondContact O-N 2.76Å; Q90-K93 PolarHBondContact O-N 3.31Å; H91-K93 VanDerWaalsContact C-N 3.31Å; H91-K93 PolarHBondContact O-N 3.42Å; K93-F152 HydrophobicContact CB-CE2 4.38Å; K93-F152 HydrophobicContact CG-CB 4.39Å; K93-F152 HydrophobicContact CG-CD2 3.76Å; K93-F152 HydrophobicContact CG-CE2 4.11Å; K93-F152 HydrophobicContact CG-CG 4.01Å; K93-Y376 HydrophobicContact CB-CE1 4.38Å; K93-Y376 HydrophobicContact CD-CE1 4.3Å; K93-Y376 HydrophobicContact CG-CE1 4.35Å
94	R	90.4	Very high	94.3	Very high	224 Å²	224	63.6 Å²	63.6	85%	0.845	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-2.2	-179.7	-60.5	-177	-178.1	177.8	-0.1	113.5	H91 S92	H91-R94 PolarHBondContact O-N 3.46Å; S92-R94 PolarHBondContact O-N 3.42Å; S92-R94 VanDerWaalsContact O-N 3.1Å
95	K	93	Very high	94.1	Very high	87 Å²	87	66.2 Å²	66.2	38%	0.378	30%	0.303	S	S	.	.	S	Bend	trans	-89.6	154.1	-179.9	-72.7	-178.9	172.4	179.1	0	110.1	H91 S92 H133 T134	H91-K95 WeakPolarHBondContact CD2-CE 3.33Å; H91-K95 PolarHBondContact CD2-NZ 3.03Å; H91-K95 WeakPolarHBondContact NE2-CE 3.07Å; H91-K95 PolarHBondContact NE2-NZ 3.25Å; S92-K95 PolarHBondContact O-N 2.82Å; K95-H133 PolarHBondContact O-CD2 3.03Å; K95-T134 HydrophobicContact CD-CG2 3.16Å; K95-T134 HydrophobicContact CG-CG2 4.47Å
96	H	92.8	Very high	93.9	Very high	173 Å²	173	71.3 Å²	71.3	80%	0.801	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-73.4	157.7	169.9	-61.4	-69.8	0	0	0	110.6	A98	H96-A98 PolarHBondContact O-N 3.19Å
97	V	95.8	Very high	93.9	Very high	20 Å²	20	69.4 Å²	69.4	12%	0.121	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-60.5	123.6	170.7	-179.5	0	0	0	0	108.2	F99 H131 L281	V97-F99 WeakPolarHBondContact CG1-O 3.36Å; V97-H131 HydrophobicContact CG1-CB 4.01Å; V97-H131 HydrophobicContact CG2-CB 3.96Å; V97-L281 HydrophobicContact CB-CD2 4.46Å; V97-L281 HydrophobicContact CG2-CD1 4.03Å; V97-L281 HydrophobicContact CG2-CD2 4.08Å
98	A	95.6	Very high	93.7	Very high	65 Å²	65	63.7 Å²	63.7	54%	0.537	30%	0.304	S	S	.	.			trans	-77.3	-48.2	176.3	0	0	0	0	0	110.3	H96 I132	H96-A98 PolarHBondContact O-N 3.19Å; A98-I132 WeakPolarHBondContact CB-O 3.49Å; A98-I132 PolarHBondContact N-O 3.5Å
99	F	95.9	Very high	93.5	Very high	67 Å²	67	62.6 Å²	62.6	29%	0.294	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	162.9	173.8	59.5	-86	0	0	0	109.9	V97 V101 I132 W141	V97-F99 WeakPolarHBondContact CG1-O 3.36Å; F99-V101 HydrophobicContact CD2-CG1 3.77Å; F99-V101 HydrophobicContact CE2-CG1 3.67Å; F99-I132 HydrophobicContact CD1-CB 4.37Å; F99-I132 HydrophobicContact CD1-CG2 4.48Å; F99-I132 HydrophobicContact CD2-CB 4.17Å; F99-I132 HydrophobicContact CD2-CG1 4.19Å; F99-I132 HydrophobicContact CE1-CB 4.04Å; F99-I132 HydrophobicContact CE1-CG2 3.76Å; F99-I132 HydrophobicContact CE2-CB 3.84Å; F99-I132 HydrophobicContact CE2-CG1 3.66Å; F99-I132 HydrophobicContact CE2-CG2 4.19Å; F99-I132 HydrophobicContact CG-CB 4.43Å; F99-I132 HydrophobicContact CZ-CB 3.76Å; F99-I132 HydrophobicContact CZ-CG1 3.95Å; F99-I132 HydrophobicContact CZ-CG2 3.59Å; F99-I132 PolarHBondContact N-O 3.31Å; F99-I132 PolarHBondContact O-N 3.39Å; F99-W141 HydrophobicContact CE2-CH2 4.12Å; F99-W141 HydrophobicContact CE2-CZ3 4.18Å; F99-W141 HydrophobicContact CZ-CD2 4.34Å; F99-W141 HydrophobicContact CZ-CE3 4.39Å; F99-W141 AromaticContact CZ-CH2 3.99Å; F99-W141 HydrophobicContact CZ-CH2 3.99Å; F99-W141 AromaticContact CZ-CZ2 3.94Å; F99-W141 HydrophobicContact CZ-CZ2 3.94Å; F99-W141 HydrophobicContact CZ-CZ3 4.22Å
100	A	96.9	Very high	93.2	Very high	1 Å²	1	65.4 Å²	65.4	1%	0.008	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	150.8	173.2	0	0	0	0	0	111.3	I130 V195	A100-I130 WeakPolarHBondContact CA-O 3.36Å; A100-V195 HydrophobicContact CB-CG2 4.05Å; A100-V195 PolarHBondContact O-N 3.38Å
101	V	96.6	Very high	92.9	Very high	1 Å²	1	67.1 Å²	67.1	1%	0.006	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	148.4	174.6	-61.5	0	0	0	0	110.4	F99 I130 I132 Y192 K193 V194	F99-V101 HydrophobicContact CD2-CG1 3.77Å; F99-V101 HydrophobicContact CE2-CG1 3.67Å; V101-I130 HydrophobicContact CG2-CB 3.88Å; V101-I130 PolarHBondContact N-O 2.68Å; V101-I130 PolarHBondContact O-N 2.89Å; V101-I132 HydrophobicContact CG2-CD1 4.48Å; V101-I132 HydrophobicContact CG2-CG1 4.29Å; V101-Y192 HydrophobicContact CB-CD1 4.21Å; V101-Y192 HydrophobicContact CB-CG 4.34Å; V101-Y192 HydrophobicContact CG2-CD1 3.77Å; V101-Y192 HydrophobicContact CG2-CE1 4.28Å; V101-Y192 HydrophobicContact CG2-CG 4.22Å; V101-K193 CarbonylContact C-O 3.59Å; V101-K193 VanDerWaalsContact CA-O 3.3Å; V101-K193 WeakPolarHBondContact CA-O 3.2Å; V101-V194 HydrophobicContact CG1-CG2 4.4Å
102	Q	95.6	Very high	92.5	Very high	26 Å²	26	62 Å²	62	12%	0.121	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	128.3	164	-176	179.3	25.4	0	0	108.3	N127 D128 F129 Y192 K193 V195 S303	Q102-N127 PolarHBondContact NE2-OD1 2.94Å; Q102-D128 WeakPolarHBondContact CA-O 3.49Å; Q102-F129 HydrophobicContact CG-CE2 4.47Å; Q102-Y192 WeakPolarHBondContact O-CA 3.38Å; Q102-K193 HydrophobicContact CB-CB 4.44Å; Q102-K193 PolarHBondContact N-O 3.47Å; Q102-K193 PolarHBondContact O-N 3.42Å; Q102-V195 HydrophobicContact CB-CG1 3.98Å; Q102-V195 HydrophobicContact CB-CG2 4.39Å; Q102-S303 PolarHBondContact OE1-OG 3.02Å
103	A	94.9	Very high	92.1	Very high	0 Å²	0	70 Å²	70	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	133.8	173.7	0	0	0	0	0	110.4	F124 N125 N127 D128 I130	A103-F124 HydrophobicContact CB-CD2 3.4Å; A103-F124 HydrophobicContact CB-CE2 3.64Å; A103-F124 HydrophobicContact CB-CG 4.38Å; A103-N125 WeakPolarHBondContact CB-O 3.11Å; A103-N127 WeakPolarHBondContact O-CA 3.49Å; A103-N127 PolarHBondContact O-N 3.02Å; A103-D128 PolarHBondContact N-O 2.9Å; A103-I130 HydrophobicContact CB-CD1 4.49Å
104	M	92	Very high	91.9	Very high	90 Å²	90	76.1 Å²	76.1	44%	0.443	37%	0.366	S	S	.	.	S	Bend	trans	-103.4	-2.6	176.3	-60.7	-161	72.4	0	0	112.8	P191 K193	M104-P191 PolarHBondContact N-O 2.77Å; M104-K193 HydrophobicContact CG-CB 4.12Å; M104-K193 HydrophobicContact SD-CB 3.91Å
105	R	89	Confident	91.8	Very high	101 Å²	101	66.2 Å²	66.2	38%	0.381	33%	0.331	S	S	.	.	S	Bend	trans	-147	157.8	178	-66.9	-171.7	65.3	171.6	-3	109.6	F124 T126 D168	R105-F124 WeakPolarHBondContact O-CE2 3.43Å; R105-T126 WeakPolarHBondContact CA-OG1 3.27Å; R105-D168 IonicContact NH2-OD2 3.87Å
106	D	91.9	Very high	91.7	Very high	107 Å²	107	62.9 Å²	62.9	57%	0.572	32%	0.319	S	S	*	.			trans	-74.5	147.1	171.2	-53.8	-15.3	0	0	0	109.9	F124 N125 T126	D106-F124 CarbonylContact C-O 3.57Å; D106-F124 WeakPolarHBondContact CA-O 3.16Å; D106-N125 WeakPolarHBondContact OD1-CA 3.33Å; D106-T126 PolarHBondContact N-OG1 2.7Å; D106-T126 WeakPolarHBondContact OD1-CB 3.32Å; D106-T126 PolarHBondContact OD1-N 2.85Å; D106-T126 PolarHBondContact OD1-OG1 3.08Å
107	Y	93	Very high	91.7	Very high	22 Å²	22	55.2 Å²	55.2	9%	0.086	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-144	124.6	175.8	170.6	-102.4	0	0	0	109.8	G109 D112 T121 I122 S123 F124 W140 P156 L161	Y107-G109 VanDerWaalsContact CE1-CA 3.48Å; Y107-D112 VanDerWaalsContact OH-CB 3.27Å; Y107-D112 WeakPolarHBondContact OH-CB 3.45Å; Y107-D112 PolarHBondContact OH-OD2 3.31Å; Y107-T121 HydrophobicContact CE1-CG2 4.12Å; Y107-I122 VanDerWaalsContact CD1-O 3.32Å; Y107-I122 WeakPolarHBondContact CD1-O 3.38Å; Y107-I122 WeakPolarHBondContact CE1-O 3.37Å; Y107-S123 CarbonylContact O-C 3.48Å; Y107-S123 VanDerWaalsContact O-CA 3.22Å; Y107-S123 WeakPolarHBondContact O-CA 3.08Å; Y107-S123 WeakPolarHBondContact O-CB 3.14Å; Y107-F124 AromaticContact CD1-CD1 4Å; Y107-F124 HydrophobicContact CD1-CD1 4Å; Y107-F124 AromaticContact CD1-CE1 3.49Å; Y107-F124 HydrophobicContact CD1-CE1 3.49Å; Y107-F124 VanDerWaalsContact CD1-CE1 3.49Å; Y107-F124 AromaticContact CD1-CZ 3.95Å; Y107-F124 HydrophobicContact CD1-CZ 3.95Å; Y107-F124 HydrophobicContact CE1-CE1 4.42Å; Y107-F124 AromaticContact CG-CE1 3.93Å; Y107-F124 HydrophobicContact CG-CE1 3.93Å; Y107-F124 AromaticContact CG-CZ 3.88Å; Y107-F124 HydrophobicContact CG-CZ 3.88Å; Y107-F124 PolarHBondContact N-O 2.89Å; Y107-F124 PolarHBondContact O-N 3.18Å; Y107-W140 VanDerWaalsContact OH-CH2 3.25Å; Y107-W140 WeakPolarHBondContact OH-CH2 3.22Å; Y107-P156 HydrophobicContact CD1-CG 3.84Å; Y107-P156 HydrophobicContact CD2-CG 4.12Å; Y107-P156 HydrophobicContact CE1-CG 3.65Å; Y107-P156 HydrophobicContact CE2-CB 4.4Å; Y107-P156 HydrophobicContact CE2-CG 3.93Å; Y107-P156 HydrophobicContact CG-CG 4.07Å; Y107-L161 HydrophobicContact CD2-CD2 3.54Å; Y107-L161 HydrophobicContact CE2-CD2 3.96Å; Y107-L161 HydrophobicContact CG-CD2 4.21Å
108	D	91.8	Very high	91.2	Very high	73 Å²	73	59.5 Å²	59.5	39%	0.39	30%	0.301	S	S	.	.			trans	-102.7	104.3	172.8	-171.5	1.1	0	0	0	111	S110 L111 S123	D108-S110 PolarHBondContact O-N 3.24Å; D108-S110 VanDerWaalsContact OD1-CB 3.29Å; D108-S110 WeakPolarHBondContact OD1-CB 3.45Å; D108-S110 PolarHBondContact OD1-N 3.44Å; D108-S110 PolarHBondContact OD1-OG 2.93Å; D108-S110 PolarHBondContact OD2-OG 3.01Å; D108-L111 HydrophobicContact CB-CD1 4.14Å; D108-L111 HydrophobicContact CB-CG 4.25Å; D108-L111 PolarHBondContact O-N 3.42Å; D108-S123 PolarHBondContact OD1-OG 3.24Å; D108-S123 VanDerWaalsContact OD1-OG 3.1Å
109	G	89.9	Confident	90.9	Very high	1 Å²	1	63.9 Å²	63.9	1%	0.01	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-66.3	-17.2	176.4	0	0	0	0	0	114.6	Y107 L111 D112 T121 S123	Y107-G109 VanDerWaalsContact CE1-CA 3.48Å; G109-L111 VanDerWaalsContact C-N 3.25Å; G109-L111 PolarHBondContact O-N 2.68Å; G109-D112 PolarHBondContact O-N 3.25Å; G109-T121 VanDerWaalsContact CA-CG2 3.5Å; G109-S123 PolarHBondContact N-OG 3.05Å
110	S	89.3	Confident	90.8	Very high	62 Å²	62	63.5 Å²	63.5	43%	0.434	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-69.1	-27.4	178.4	78.6	0	0	0	0	112.7	D108 K118	D108-S110 PolarHBondContact O-N 3.24Å; D108-S110 VanDerWaalsContact OD1-CB 3.29Å; D108-S110 WeakPolarHBondContact OD1-CB 3.45Å; D108-S110 PolarHBondContact OD1-N 3.44Å; D108-S110 PolarHBondContact OD1-OG 2.93Å; D108-S110 PolarHBondContact OD2-OG 3.01Å; S110-K118 WeakPolarHBondContact O-CE 3.4Å; S110-K118 PolarHBondContact O-NZ 3.48Å
111	L	86.7	Confident	90.7	Very high	137 Å²	137	64.3 Å²	64.3	72%	0.717	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-84.2	-13.9	179.5	-56.8	179.7	0	0	0	112.5	D108 G109 E113	D108-L111 HydrophobicContact CB-CD1 4.14Å; D108-L111 HydrophobicContact CB-CG 4.25Å; D108-L111 PolarHBondContact O-N 3.42Å; G109-L111 VanDerWaalsContact C-N 3.25Å; G109-L111 PolarHBondContact O-N 2.68Å; L111-E113 PolarHBondContact O-N 2.77Å
112	D	86.4	Confident	90.6	Very high	3 Å²	3	65.1 Å²	65.1	2%	0.016	32%	0.323	C	S	.	.			trans	-89.1	92.1	-177.1	-165	-28.6	0	0	0	112.4	Y107 G109 K114 S115 W140 R160 Y164	Y107-D112 VanDerWaalsContact OH-CB 3.27Å; Y107-D112 WeakPolarHBondContact OH-CB 3.45Å; Y107-D112 PolarHBondContact OH-OD2 3.31Å; G109-D112 PolarHBondContact O-N 3.25Å; D112-K114 PolarHBondContact O-N 2.75Å; D112-K114 WeakPolarHBondContact OD1-CA 3.37Å; D112-K114 PolarHBondContact OD1-N 2.85Å; D112-S115 WeakPolarHBondContact O-CB 3.16Å; D112-S115 PolarHBondContact O-N 2.71Å; D112-W140 HydrophobicContact CB-CH2 4.45Å; D112-R160 IonicContact OD1-CZ 2.77Å; D112-R160 IonicContact OD1-NE 2.7Å; D112-R160 IonicContact OD1-NH2 3.34Å; D112-R160 PolarHBondContact OD1-NH2 3.05Å; D112-R160 IonicContact OD2-CZ 2.72Å; D112-R160 VanDerWaalsContact OD2-CZ 3.26Å; D112-R160 IonicContact OD2-NE 2.75Å; D112-R160 PolarHBondContact OD2-NE 3.44Å; D112-R160 IonicContact OD2-NH2 3.92Å; D112-R160 PolarHBondContact OD2-NH2 2.93Å; D112-Y164 PolarHBondContact OD1-OH 3.4Å; D112-Y164 PolarHBondContact OD2-OH 3.39Å
113	E	85.6	Confident	90.6	Very high	169 Å²	169	66.4 Å²	66.4	79%	0.79	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-16.8	177.9	-60.7	-166.6	154.8	0	0	114.5	L111 S115	L111-E113 PolarHBondContact O-N 2.77Å; E113-S115 VanDerWaalsContact C-N 3.25Å; E113-S115 PolarHBondContact O-N 3.05Å
114	K	86.8	Confident	90.6	Very high	169 Å²	169	66.6 Å²	66.6	74%	0.735	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	16.7	-178.8	-71.1	176.2	-171.2	173.1	0	111.3	D112 W140 R160	D112-K114 PolarHBondContact O-N 2.75Å; D112-K114 WeakPolarHBondContact OD1-CA 3.37Å; D112-K114 PolarHBondContact OD1-N 2.85Å; K114-W140 PolarHBondContact O-NE1 3.36Å; K114-R160 PolarHBondContact O-NH2 2.88Å
115	S	88.9	Confident	90.8	Very high	17 Å²	17	67 Å²	67	12%	0.119	34%	0.34	C	S	.	.			trans	-73	140.2	172.6	-177.9	0	0	0	0	111.8	D112 E113 L117 T121	D112-S115 WeakPolarHBondContact O-CB 3.16Å; D112-S115 PolarHBondContact O-N 2.71Å; E113-S115 VanDerWaalsContact C-N 3.25Å; E113-S115 PolarHBondContact O-N 3.05Å; S115-L117 PolarHBondContact O-N 2.9Å; S115-L117 PolarHBondContact OG-O 3.22Å; S115-T121 VanDerWaalsContact CB-OG1 3.25Å; S115-T121 WeakPolarHBondContact CB-OG1 3.43Å; S115-T121 PolarHBondContact OG-OG1 3.28Å
116	P	90.3	Very high	90.9	Very high	17 Å²	17	65 Å²	65	11%	0.11	34%	0.339	C	S	.	.	S	Bend	trans	-61.7	-33	177.2	-21.4	34.2	0	0	0	112.1	A85 F136 W140 F154	A85-P116 HydrophobicContact CB-CB 3.81Å; P116-F136 HydrophobicContact CB-CD1 4.39Å; P116-F136 HydrophobicContact CB-CE1 3.73Å; P116-F136 HydrophobicContact CB-CZ 4.26Å; P116-F136 HydrophobicContact CG-CD1 3.81Å; P116-F136 HydrophobicContact CG-CE1 3.52Å; P116-F136 HydrophobicContact CG-CZ 4.49Å; P116-W140 HydrophobicContact CG-CB 4.44Å; P116-W140 HydrophobicContact CG-CD2 4.48Å; P116-W140 HydrophobicContact CG-CG 3.97Å; P116-F154 HydrophobicContact CB-CD1 4.33Å; P116-F154 HydrophobicContact CB-CE1 4.06Å; P116-F154 HydrophobicContact CB-CZ 4.28Å; P116-F154 HydrophobicContact CG-CD1 3.89Å; P116-F154 HydrophobicContact CG-CE1 4.02Å; P116-F154 HydrophobicContact CG-CG 4.42Å
117	L	91.8	Very high	90.9	Very high	11 Å²	11	64.8 Å²	64.8	6%	0.058	34%	0.337	C	S	.	.	S	Bend	trans	-143.2	100.5	177.2	-71.5	173.9	0	0	0	108.9	H82 A85 L86 S115 D119 H120 T121 F154	H82-L117 WeakPolarHBondContact CD2-CD2 3.47Å; H82-L117 VanDerWaalsContact NE2-CD2 3.35Å; H82-L117 WeakPolarHBondContact NE2-CD2 3.38Å; A85-L117 HydrophobicContact CB-CD1 3.73Å; A85-L117 HydrophobicContact CB-CG 3.78Å; L86-L117 HydrophobicContact CD2-CD1 3.63Å; L86-L117 HydrophobicContact CD2-CD2 4.27Å; L86-L117 HydrophobicContact CG-CD1 3.87Å; L86-L117 HydrophobicContact CG-CD2 4.25Å; S115-L117 PolarHBondContact O-N 2.9Å; S115-L117 PolarHBondContact OG-O 3.22Å; L117-D119 VanDerWaalsContact C-N 3.31Å; L117-D119 PolarHBondContact O-N 3.39Å; L117-H120 HydrophobicContact CB-CB 4.09Å; L117-H120 CarbonylContact O-C 3.53Å; L117-H120 PolarHBondContact O-N 3.48Å; L117-T121 PolarHBondContact O-N 2.95Å; L117-T121 PolarHBondContact O-OG1 3.44Å; L117-T121 VanDerWaalsContact O-OG1 3.08Å; L117-F154 HydrophobicContact CB-CD2 4.04Å; L117-F154 HydrophobicContact CB-CE2 3.7Å; L117-F154 HydrophobicContact CD1-CE2 3.6Å; L117-F154 HydrophobicContact CD1-CZ 4.04Å; L117-F154 HydrophobicContact CG-CE2 3.94Å; L117-F154 HydrophobicContact CG-CZ 4.44Å
118	K	86.8	Confident	91	Very high	111 Å²	111	65 Å²	65	48%	0.483	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-54.8	-47.4	-175.7	-165.5	170	-176.1	172.4	0	111.8	S110 H120 T121	S110-K118 WeakPolarHBondContact O-CE 3.4Å; S110-K118 PolarHBondContact O-NZ 3.48Å; K118-H120 PolarHBondContact O-N 3.33Å; K118-H120 VanDerWaalsContact O-N 3.09Å; K118-T121 WeakPolarHBondContact O-CB 3.23Å; K118-T121 PolarHBondContact O-N 3.19Å; K118-T121 VanDerWaalsContact O-N 3.11Å; K118-T121 PolarHBondContact O-OG1 3.02Å
119	D	88.9	Confident	91.2	Very high	156 Å²	156	62.9 Å²	62.9	83%	0.834	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-65.9	-13.3	-179	-55.3	-23.7	0	0	0	114.4	L117	L117-D119 VanDerWaalsContact C-N 3.31Å; L117-D119 PolarHBondContact O-N 3.39Å
120	H	93.1	Very high	91.6	Very high	59 Å²	59	62.8 Å²	62.8	27%	0.273	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-117.5	19.7	179.8	-63.7	69.7	0	0	0	111.4	L89 L117 K118 G153 F154	L89-H120 HydrophobicContact CD1-CB 3.83Å; L117-H120 HydrophobicContact CB-CB 4.09Å; L117-H120 CarbonylContact O-C 3.53Å; L117-H120 PolarHBondContact O-N 3.48Å; K118-H120 PolarHBondContact O-N 3.33Å; K118-H120 VanDerWaalsContact O-N 3.09Å; H120-G153 CarbonylContact O-C 3.35Å; H120-G153 WeakPolarHBondContact O-CA 2.92Å; H120-F154 HydrophobicContact CB-CD2 4.19Å; H120-F154 HydrophobicContact CB-CE2 4.35Å; H120-F154 PolarHBondContact O-N 3.03Å
121	T	95.3	Very high	91.9	Very high	19 Å²	19	60 Å²	60	12%	0.117	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-83.1	128.5	175.8	-46.4	0	0	0	0	109.3	Y107 G109 S115 L117 K118 S123 W140	Y107-T121 HydrophobicContact CE1-CG2 4.12Å; G109-T121 VanDerWaalsContact CA-CG2 3.5Å; S115-T121 VanDerWaalsContact CB-OG1 3.25Å; S115-T121 WeakPolarHBondContact CB-OG1 3.43Å; S115-T121 PolarHBondContact OG-OG1 3.28Å; L117-T121 PolarHBondContact O-N 2.95Å; L117-T121 PolarHBondContact O-OG1 3.44Å; L117-T121 VanDerWaalsContact O-OG1 3.08Å; K118-T121 WeakPolarHBondContact O-CB 3.23Å; K118-T121 PolarHBondContact O-N 3.19Å; K118-T121 VanDerWaalsContact O-N 3.11Å; K118-T121 PolarHBondContact O-OG1 3.02Å; T121-S123 PolarHBondContact O-N 2.78Å; T121-W140 HydrophobicContact CG2-CH2 3.67Å; T121-W140 HydrophobicContact CG2-CZ3 3.75Å
122	I	95.4	Very high	92.5	Very high	17 Å²	17	53.5 Å²	53.5	9%	0.087	27%	0.273	C	S	.	.			trans	-85.3	114.8	-178.1	-64	179.1	0	0	0	109.2	Y107 F124 G143 I145 F154 V155	Y107-I122 VanDerWaalsContact CD1-O 3.32Å; Y107-I122 WeakPolarHBondContact CD1-O 3.38Å; Y107-I122 WeakPolarHBondContact CE1-O 3.37Å; I122-F124 HydrophobicContact CG2-CD1 4.3Å; I122-G143 VanDerWaalsContact CD1-O 3.27Å; I122-G143 WeakPolarHBondContact CD1-O 3.47Å; I122-I145 HydrophobicContact CG2-CD1 3.55Å; I122-I145 HydrophobicContact CG2-CG1 3.45Å; I122-I145 VanDerWaalsContact CG2-CG1 3.45Å; I122-F154 PolarHBondContact N-O 3.44Å; I122-V155 HydrophobicContact CB-CG2 4.33Å; I122-V155 HydrophobicContact CD1-CG2 3.77Å; I122-V155 HydrophobicContact CG1-CG2 4.48Å
123	S	95.3	Very high	92.9	Very high	53 Å²	53	54.2 Å²	54.2	37%	0.371	28%	0.276	S	S	.	.			trans	-85	139.3	164	-55	0	0	0	0	109.9	Y107 D108 G109 T121 I145	Y107-S123 CarbonylContact O-C 3.48Å; Y107-S123 VanDerWaalsContact O-CA 3.22Å; Y107-S123 WeakPolarHBondContact O-CA 3.08Å; Y107-S123 WeakPolarHBondContact O-CB 3.14Å; D108-S123 PolarHBondContact OD1-OG 3.24Å; D108-S123 VanDerWaalsContact OD1-OG 3.1Å; G109-S123 PolarHBondContact N-OG 3.05Å; T121-S123 PolarHBondContact O-N 2.78Å; S123-I145 VanDerWaalsContact O-CD1 3.3Å; S123-I145 WeakPolarHBondContact O-CD1 3.35Å
124	F	95.4	Very high	93.5	Very high	5 Å²	5	47.2 Å²	47.2	2%	0.022	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-146.8	155.9	-177.9	54.4	-98.3	0	0	0	111.3	A103 R105 D106 Y107 I122 D128 I130 I145 V155 P156 L161 Y192	A103-F124 HydrophobicContact CB-CD2 3.4Å; A103-F124 HydrophobicContact CB-CE2 3.64Å; A103-F124 HydrophobicContact CB-CG 4.38Å; R105-F124 WeakPolarHBondContact O-CE2 3.43Å; D106-F124 CarbonylContact C-O 3.57Å; D106-F124 WeakPolarHBondContact CA-O 3.16Å; Y107-F124 AromaticContact CD1-CD1 4Å; Y107-F124 HydrophobicContact CD1-CD1 4Å; Y107-F124 AromaticContact CD1-CE1 3.49Å; Y107-F124 HydrophobicContact CD1-CE1 3.49Å; Y107-F124 VanDerWaalsContact CD1-CE1 3.49Å; Y107-F124 AromaticContact CD1-CZ 3.95Å; Y107-F124 HydrophobicContact CD1-CZ 3.95Å; Y107-F124 HydrophobicContact CE1-CE1 4.42Å; Y107-F124 AromaticContact CG-CE1 3.93Å; Y107-F124 HydrophobicContact CG-CE1 3.93Å; Y107-F124 AromaticContact CG-CZ 3.88Å; Y107-F124 HydrophobicContact CG-CZ 3.88Å; Y107-F124 PolarHBondContact N-O 2.89Å; Y107-F124 PolarHBondContact O-N 3.18Å; I122-F124 HydrophobicContact CG2-CD1 4.3Å; F124-D128 HydrophobicContact CB-CB 4.08Å; F124-I130 HydrophobicContact CB-CD1 4.18Å; F124-I130 HydrophobicContact CD1-CD1 3.64Å; F124-I130 HydrophobicContact CD2-CD1 4.15Å; F124-I130 HydrophobicContact CE1-CD1 3.99Å; F124-I130 HydrophobicContact CE2-CD1 4.47Å; F124-I130 HydrophobicContact CG-CD1 3.72Å; F124-I130 HydrophobicContact CZ-CD1 4.4Å; F124-I145 HydrophobicContact CB-CD1 4.11Å; F124-V155 HydrophobicContact CE1-CG1 4.38Å; F124-P156 HydrophobicContact CE1-CG 4.12Å; F124-P156 HydrophobicContact CZ-CG 4.26Å; F124-L161 HydrophobicContact CZ-CD1 4.35Å; F124-Y192 HydrophobicContact CE1-CE1 4.42Å; F124-Y192 HydrophobicContact CE2-CE1 4.07Å; F124-Y192 AromaticContact CZ-CE1 3.71Å; F124-Y192 HydrophobicContact CZ-CE1 3.71Å; F124-Y192 AromaticContact CZ-CZ 3.88Å; F124-Y192 VanDerWaalsContact CZ-OH 3.27Å; F124-Y192 WeakPolarHBondContact CZ-OH 3.2Å
125	N	95	Very high	94	Very high	99 Å²	99	45.6 Å²	45.6	53%	0.529	24%	0.238	S	C	.	.			trans	-101.5	167.3	176.3	-63	-25.7	0	0	0	110.9	A103 D106 N127 D128	A103-N125 WeakPolarHBondContact CB-O 3.11Å; D106-N125 WeakPolarHBondContact OD1-CA 3.33Å; N125-N127 PolarHBondContact O-N 3.47Å; N125-D128 PolarHBondContact N-OD2 3.27Å; N125-D128 VanDerWaalsContact O-CB 3.28Å; N125-D128 WeakPolarHBondContact O-CB 3.46Å; N125-D128 PolarHBondContact O-N 3.44Å
126	T	92.4	Very high	94.3	Very high	59 Å²	59	47 Å²	47	36%	0.362	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	136.3	171.4	-57.5	0	0	0	0	109.2	R105 D106 D128	R105-T126 WeakPolarHBondContact CA-OG1 3.27Å; D106-T126 PolarHBondContact N-OG1 2.7Å; D106-T126 WeakPolarHBondContact OD1-CB 3.32Å; D106-T126 PolarHBondContact OD1-N 2.85Å; D106-T126 PolarHBondContact OD1-OG1 3.08Å; T126-D128 VanDerWaalsContact C-N 3.26Å; T126-D128 PolarHBondContact O-N 3.21Å
127	N	91.9	Very high	94.5	Very high	101 Å²	101	48.3 Å²	48.3	54%	0.54	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.7	0.6	-173.3	-54.2	-47	0	0	0	116.6	Q102 A103 N125 F129	Q102-N127 PolarHBondContact NE2-OD1 2.94Å; A103-N127 WeakPolarHBondContact O-CA 3.49Å; A103-N127 PolarHBondContact O-N 3.02Å; N125-N127 PolarHBondContact O-N 3.47Å; N127-F129 WeakPolarHBondContact O-CD2 3.4Å
128	D	95.1	Very high	94.6	Very high	28 Å²	28	50.5 Å²	50.5	15%	0.15	26%	0.264	C	S	.	.			trans	-62.5	139.8	170.2	-86.4	-31.5	0	0	0	110.6	Q102 A103 F124 N125 T126 R147	Q102-D128 WeakPolarHBondContact CA-O 3.49Å; A103-D128 PolarHBondContact N-O 2.9Å; F124-D128 HydrophobicContact CB-CB 4.08Å; N125-D128 PolarHBondContact N-OD2 3.27Å; N125-D128 VanDerWaalsContact O-CB 3.28Å; N125-D128 WeakPolarHBondContact O-CB 3.46Å; N125-D128 PolarHBondContact O-N 3.44Å; T126-D128 VanDerWaalsContact C-N 3.26Å; T126-D128 PolarHBondContact O-N 3.21Å; D128-R147 IonicContact OD1-NH2 2.91Å; D128-R147 PolarHBondContact OD1-NH2 2.88Å; D128-R147 VanDerWaalsContact OD1-NH2 3.15Å; D128-R147 IonicContact OD2-NH2 3.26Å
129	F	95.6	Very high	95	Very high	27 Å²	27	47.1 Å²	47.1	12%	0.118	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	132.8	175.9	-79.5	-102.7	0	0	0	110.2	Q102 N127 I145 V146 V195 R199	Q102-F129 HydrophobicContact CG-CE2 4.47Å; N127-F129 WeakPolarHBondContact O-CD2 3.4Å; F129-I145 WeakPolarHBondContact O-CA 3.07Å; F129-V146 HydrophobicContact CB-CB 3.98Å; F129-V146 HydrophobicContact CB-CG2 3.91Å; F129-V146 PolarHBondContact O-N 3.08Å; F129-V195 HydrophobicContact CD1-CG2 3.85Å; F129-V195 HydrophobicContact CE1-CB 4.32Å; F129-V195 HydrophobicContact CE1-CG2 3.75Å; F129-R199 HydrophobicContact CD1-CG 4.03Å; F129-R199 HydrophobicContact CE1-CG 3.45Å; F129-R199 VanDerWaalsContact CE1-CG 3.45Å; F129-R199 HydrophobicContact CE2-CG 4.44Å; F129-R199 HydrophobicContact CZ-CG 3.66Å; F129-R199 VanDerWaalsContact CZ-NE 3.27Å
130	I	97.1	Very high	95.3	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	126.3	-173.8	-47.4	175	0	0	0	109.2	A100 V101 A103 F124 I132 R144 V155 Y192	A100-I130 WeakPolarHBondContact CA-O 3.36Å; V101-I130 HydrophobicContact CG2-CB 3.88Å; V101-I130 PolarHBondContact N-O 2.68Å; V101-I130 PolarHBondContact O-N 2.89Å; A103-I130 HydrophobicContact CB-CD1 4.49Å; F124-I130 HydrophobicContact CB-CD1 4.18Å; F124-I130 HydrophobicContact CD1-CD1 3.64Å; F124-I130 HydrophobicContact CD2-CD1 4.15Å; F124-I130 HydrophobicContact CE1-CD1 3.99Å; F124-I130 HydrophobicContact CE2-CD1 4.47Å; F124-I130 HydrophobicContact CG-CD1 3.72Å; F124-I130 HydrophobicContact CZ-CD1 4.4Å; I130-I132 HydrophobicContact CG2-CD1 3.89Å; I130-R144 CarbonylContact C-O 3.47Å; I130-R144 WeakPolarHBondContact CA-O 3.44Å; I130-R144 WeakPolarHBondContact CG2-O 3.4Å; I130-V155 HydrophobicContact CD1-CG1 4.4Å; I130-V155 HydrophobicContact CG2-CG1 4.3Å; I130-V155 HydrophobicContact CG2-CG2 3.88Å; I130-Y192 HydrophobicContact CD1-CE1 4.25Å
131	H	97.3	Very high	95.5	Very high	3 Å²	3	39.1 Å²	39.1	1%	0.014	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	116.2	172.8	-73.7	177.6	0	0	0	110.5	V97 H133 G143 R144 V146 S197	V97-H131 HydrophobicContact CG1-CB 4.01Å; V97-H131 HydrophobicContact CG2-CB 3.96Å; H131-H133 PolarHBondContact O-ND1 2.84Å; H131-H133 VanDerWaalsContact O-ND1 3.13Å; H131-G143 CarbonylContact O-C 3.52Å; H131-G143 WeakPolarHBondContact O-CA 3.49Å; H131-R144 HydrophobicContact CB-CG 4.27Å; H131-R144 PolarHBondContact N-O 2.89Å; H131-R144 PolarHBondContact O-N 2.94Å; H131-V146 WeakPolarHBondContact CD2-CG2 3.38Å; H131-V146 VanDerWaalsContact NE2-CG2 3.26Å; H131-V146 WeakPolarHBondContact NE2-CG2 3.43Å; H131-S197 PolarHBondContact NE2-O 3.03Å
132	I	97.8	Very high	95.7	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	129.4	175.7	-53.8	-55.3	0	0	0	109.3	A98 F99 V101 I130 W141 V155	A98-I132 WeakPolarHBondContact CB-O 3.49Å; A98-I132 PolarHBondContact N-O 3.5Å; F99-I132 HydrophobicContact CD1-CB 4.37Å; F99-I132 HydrophobicContact CD1-CG2 4.48Å; F99-I132 HydrophobicContact CD2-CB 4.17Å; F99-I132 HydrophobicContact CD2-CG1 4.19Å; F99-I132 HydrophobicContact CE1-CB 4.04Å; F99-I132 HydrophobicContact CE1-CG2 3.76Å; F99-I132 HydrophobicContact CE2-CB 3.84Å; F99-I132 HydrophobicContact CE2-CG1 3.66Å; F99-I132 HydrophobicContact CE2-CG2 4.19Å; F99-I132 HydrophobicContact CG-CB 4.43Å; F99-I132 HydrophobicContact CZ-CB 3.76Å; F99-I132 HydrophobicContact CZ-CG1 3.95Å; F99-I132 HydrophobicContact CZ-CG2 3.59Å; F99-I132 PolarHBondContact N-O 3.31Å; F99-I132 PolarHBondContact O-N 3.39Å; V101-I132 HydrophobicContact CG2-CD1 4.48Å; V101-I132 HydrophobicContact CG2-CG1 4.29Å; I130-I132 HydrophobicContact CG2-CD1 3.89Å; I132-W141 HydrophobicContact CD1-CB 4.27Å; I132-W141 HydrophobicContact CD1-CD2 4.41Å; I132-W141 HydrophobicContact CD1-CE3 3.7Å; I132-W141 HydrophobicContact CD1-CZ3 4.46Å; I132-W141 HydrophobicContact CG1-CD2 4.49Å; I132-W141 HydrophobicContact CG1-CE3 3.87Å; I132-W141 HydrophobicContact CG1-CZ3 4.33Å; I132-W141 HydrophobicContact CG2-CB 3.9Å; I132-W141 HydrophobicContact CG2-CD2 4.05Å; I132-W141 HydrophobicContact CG2-CE3 4.28Å; I132-W141 HydrophobicContact CG2-CG 3.91Å; I132-V155 HydrophobicContact CD1-CB 4.08Å; I132-V155 HydrophobicContact CD1-CG1 3.99Å; I132-V155 HydrophobicContact CD1-CG2 4.12Å
133	H	96.3	Very high	95.7	Very high	17 Å²	17	37.4 Å²	37.4	8%	0.079	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	-43.2	-176.4	-67.3	71.3	0	0	0	111.6	K95 H131 I142 F152	K95-H133 PolarHBondContact O-CD2 3.03Å; H131-H133 PolarHBondContact O-ND1 2.84Å; H131-H133 VanDerWaalsContact O-ND1 3.13Å; H133-I142 PolarHBondContact N-O 3.46Å; H133-F152 HydrophobicContact CB-CE1 4.17Å; H133-F152 AromaticContact CD2-CE1 3.62Å; H133-F152 AromaticContact CD2-CZ 3.75Å; H133-F152 AromaticContact CE1-CE1 3.6Å; H133-F152 AromaticContact CE1-CZ 3.64Å; H133-F152 AromaticContact CG-CE1 3.54Å; H133-F152 AromaticContact ND1-CE1 3.53Å; H133-F152 AromaticContact NE2-CE1 3.67Å; H133-F152 AromaticContact NE2-CZ 3.44Å; H133-F152 WeakPolarHBondContact NE2-CZ 3.39Å
134	T	96.9	Very high	95.8	Very high	22 Å²	22	35.1 Å²	35.1	14%	0.135	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	159.2	179.7	65.6	0	0	0	0	112.7	S92 K95 W141 I142	S92-T134 PolarHBondContact OG-OG1 2.86Å; K95-T134 HydrophobicContact CD-CG2 3.16Å; K95-T134 HydrophobicContact CG-CG2 4.47Å; T134-W141 CarbonylContact O-C 3.56Å; T134-W141 WeakPolarHBondContact O-CA 3.47Å; T134-I142 PolarHBondContact N-O 2.98Å; T134-I142 PolarHBondContact O-N 2.58Å
135	K	97.1	Very high	95.8	Very high	135 Å²	135	35.5 Å²	35.5	59%	0.587	18%	0.183	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-88.8	124.7	164.4	-176	178.1	179.6	-179.1	0	109.1	N137	K135-N137 WeakPolarHBondContact CE-O 3.16Å; K135-N137 WeakPolarHBondContact CG-O 3.17Å
136	F	96.2	Very high	95.8	Very high	48 Å²	48	32 Å²	32	21%	0.211	17%	0.165	C	C	.	.			trans	-84	-59.2	172.4	175.2	-112.1	0	0	0	110.2	E81 A85 A88 P116 W140 I142 F154	E81-F136 HydrophobicContact CG-CZ 4.33Å; A85-F136 HydrophobicContact CB-CE2 4.1Å; A85-F136 HydrophobicContact CB-CZ 3.84Å; A88-F136 HydrophobicContact CB-CD2 3.82Å; A88-F136 HydrophobicContact CB-CE2 4.12Å; P116-F136 HydrophobicContact CB-CD1 4.39Å; P116-F136 HydrophobicContact CB-CE1 3.73Å; P116-F136 HydrophobicContact CB-CZ 4.26Å; P116-F136 HydrophobicContact CG-CD1 3.81Å; P116-F136 HydrophobicContact CG-CE1 3.52Å; P116-F136 HydrophobicContact CG-CZ 4.49Å; F136-W140 HydrophobicContact CB-CB 4.41Å; F136-W140 WeakPolarHBondContact CB-O 3.48Å; F136-W140 HydrophobicContact CD1-CB 4.23Å; F136-W140 PolarHBondContact N-O 3.46Å; F136-I142 HydrophobicContact CB-CD1 4.07Å; F136-I142 HydrophobicContact CB-CG1 3.97Å; F136-I142 HydrophobicContact CD2-CD1 4.36Å; F136-F154 HydrophobicContact CB-CD1 4.49Å; F136-F154 HydrophobicContact CB-CE1 4.16Å; F136-F154 HydrophobicContact CD1-CD1 4.35Å; F136-F154 AromaticContact CD1-CE1 3.9Å; F136-F154 HydrophobicContact CD1-CE1 3.9Å; F136-F154 HydrophobicContact CD2-CE1 4.17Å; F136-F154 HydrophobicContact CE1-CE1 4.34Å; F136-F154 HydrophobicContact CG-CD1 4.44Å; F136-F154 AromaticContact CG-CE1 3.81Å; F136-F154 HydrophobicContact CG-CE1 3.81Å
137	N	94.6	Very high	95.7	Very high	44 Å²	44	35.6 Å²	35.6	24%	0.235	17%	0.172	C	C	.	.	S	Bend	trans	-143.1	-166.1	174.7	69.1	22.1	0	0	0	109.8	K135 D139 W140	K135-N137 WeakPolarHBondContact CE-O 3.16Å; K135-N137 WeakPolarHBondContact CG-O 3.17Å; N137-D139 PolarHBondContact O-N 2.85Å; N137-D139 PolarHBondContact OD1-N 3.06Å; N137-W140 PolarHBondContact N-O 3.24Å; N137-W140 VanDerWaalsContact N-O 3.11Å; N137-W140 PolarHBondContact OD1-N 2.93Å
138	S	93.8	Very high	95.4	Very high	56 Å²	56	33 Å²	33	39%	0.392	16%	0.161	S	C	.	.	S	Bend	trans	-72.5	-17.3	-176.6	-61	0	0	0	0	113.9	T157 R159	S138-T157 PolarHBondContact O-OG1 3.4Å; S138-R159 PolarHBondContact O-NE 3.1Å
139	D	93.8	Very high	94.8	Very high	41 Å²	41	38.6 Å²	38.6	22%	0.219	19%	0.187	C	C	.	.	S	Bend	trans	-109.3	-14.5	-178.7	-61	-38.5	0	0	0	113.5	N137 T157 R159 R160	N137-D139 PolarHBondContact O-N 2.85Å; N137-D139 PolarHBondContact OD1-N 3.06Å; D139-T157 WeakPolarHBondContact CA-OG1 3.36Å; D139-T157 PolarHBondContact O-N 3.21Å; D139-T157 PolarHBondContact O-OG1 3.41Å; D139-R159 VanDerWaalsContact CG-NH2 3.3Å; D139-R159 IonicContact OD1-CZ 2.87Å; D139-R159 VanDerWaalsContact OD1-CZ 3.3Å; D139-R159 IonicContact OD1-NE 3.69Å; D139-R159 PolarHBondContact OD1-NE 2.93Å; D139-R159 IonicContact OD1-NH2 3.06Å; D139-R159 PolarHBondContact OD1-NH2 3.34Å; D139-R159 IonicContact OD2-NH2 3.3Å; D139-R159 PolarHBondContact OD2-NH2 3.44Å; D139-R160 HydrophobicContact CB-CB 4.04Å; D139-R160 HydrophobicContact CB-CG 4.19Å; D139-R160 WeakPolarHBondContact O-CB 3.41Å; D139-R160 VanDerWaalsContact O-CD 3.31Å; D139-R160 WeakPolarHBondContact O-CD 3.42Å
140	W	96	Very high	94.5	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.008	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	131.3	-175.4	-62.8	101.2	0	0	0	113.4	Y107 D112 K114 P116 T121 F136 N137 F154 P156 R160	Y107-W140 VanDerWaalsContact OH-CH2 3.25Å; Y107-W140 WeakPolarHBondContact OH-CH2 3.22Å; D112-W140 HydrophobicContact CB-CH2 4.45Å; K114-W140 PolarHBondContact O-NE1 3.36Å; P116-W140 HydrophobicContact CG-CB 4.44Å; P116-W140 HydrophobicContact CG-CD2 4.48Å; P116-W140 HydrophobicContact CG-CG 3.97Å; T121-W140 HydrophobicContact CG2-CH2 3.67Å; T121-W140 HydrophobicContact CG2-CZ3 3.75Å; F136-W140 HydrophobicContact CB-CB 4.41Å; F136-W140 WeakPolarHBondContact CB-O 3.48Å; F136-W140 HydrophobicContact CD1-CB 4.23Å; F136-W140 PolarHBondContact N-O 3.46Å; N137-W140 PolarHBondContact N-O 3.24Å; N137-W140 VanDerWaalsContact N-O 3.11Å; N137-W140 PolarHBondContact OD1-N 2.93Å; W140-F154 HydrophobicContact CB-CD1 4.15Å; W140-F154 HydrophobicContact CD2-CB 4.28Å; W140-F154 HydrophobicContact CE3-CB 3.64Å; W140-F154 HydrophobicContact CZ3-CB 4.01Å; W140-P156 HydrophobicContact CE3-CB 4.24Å; W140-P156 HydrophobicContact CH2-CB 4.48Å; W140-P156 HydrophobicContact CZ3-CB 3.95Å; W140-P156 HydrophobicContact CZ3-CG 4.47Å; W140-R160 VanDerWaalsContact CE2-NE 3.33Å
141	W	97.9	Very high	94.2	Very high	45 Å²	45	42.5 Å²	42.5	17%	0.17	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	165.7	161.3	-65.4	-29	0	0	0	110.5	F99 I132 T134 F154 V155 T157 Y192	F99-W141 HydrophobicContact CE2-CH2 4.12Å; F99-W141 HydrophobicContact CE2-CZ3 4.18Å; F99-W141 HydrophobicContact CZ-CD2 4.34Å; F99-W141 HydrophobicContact CZ-CE3 4.39Å; F99-W141 AromaticContact CZ-CH2 3.99Å; F99-W141 HydrophobicContact CZ-CH2 3.99Å; F99-W141 AromaticContact CZ-CZ2 3.94Å; F99-W141 HydrophobicContact CZ-CZ2 3.94Å; F99-W141 HydrophobicContact CZ-CZ3 4.22Å; I132-W141 HydrophobicContact CD1-CB 4.27Å; I132-W141 HydrophobicContact CD1-CD2 4.41Å; I132-W141 HydrophobicContact CD1-CE3 3.7Å; I132-W141 HydrophobicContact CD1-CZ3 4.46Å; I132-W141 HydrophobicContact CG1-CD2 4.49Å; I132-W141 HydrophobicContact CG1-CE3 3.87Å; I132-W141 HydrophobicContact CG1-CZ3 4.33Å; I132-W141 HydrophobicContact CG2-CB 3.9Å; I132-W141 HydrophobicContact CG2-CD2 4.05Å; I132-W141 HydrophobicContact CG2-CE3 4.28Å; I132-W141 HydrophobicContact CG2-CG 3.91Å; T134-W141 CarbonylContact O-C 3.56Å; T134-W141 WeakPolarHBondContact O-CA 3.47Å; W141-F154 WeakPolarHBondContact O-CA 3.31Å; W141-V155 HydrophobicContact CB-CB 4.33Å; W141-V155 PolarHBondContact N-O 2.69Å; W141-V155 PolarHBondContact O-N 3.19Å; W141-T157 HydrophobicContact CD2-CG2 3.91Å; W141-T157 HydrophobicContact CG-CG2 3.9Å; W141-T157 HydrophobicContact CZ2-CG2 4.29Å; W141-Y192 HydrophobicContact CH2-CD2 4.45Å; W141-Y192 HydrophobicContact CZ3-CD2 4.01Å; W141-Y192 HydrophobicContact CZ3-CE2 4.02Å
142	I	98	Very high	94.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	126.8	168.6	-56	175.9	0	0	0	107.6	A88 H133 T134 F136 F152 G153 F154	A88-I142 HydrophobicContact CB-CD1 3.59Å; H133-I142 PolarHBondContact N-O 3.46Å; T134-I142 PolarHBondContact N-O 2.98Å; T134-I142 PolarHBondContact O-N 2.58Å; F136-I142 HydrophobicContact CB-CD1 4.07Å; F136-I142 HydrophobicContact CB-CG1 3.97Å; F136-I142 HydrophobicContact CD2-CD1 4.36Å; I142-F152 HydrophobicContact CG2-CD1 4.19Å; I142-G153 WeakPolarHBondContact CA-O 3.38Å; I142-F154 HydrophobicContact CD1-CE1 4.11Å; I142-F154 HydrophobicContact CD1-CZ 4.45Å; I142-F154 HydrophobicContact CG1-CD1 4.15Å; I142-F154 HydrophobicContact CG1-CE1 3.93Å
143	G	97.2	Very high	94.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	-165.2	-175.3	0	0	0	0	0	112.2	I122 H131 F152 G153	I122-G143 VanDerWaalsContact CD1-O 3.27Å; I122-G143 WeakPolarHBondContact CD1-O 3.47Å; H131-G143 CarbonylContact O-C 3.52Å; H131-G143 WeakPolarHBondContact O-CA 3.49Å; G143-F152 CarbonylContact O-C 3.57Å; G143-F152 VanDerWaalsContact O-CA 3.31Å; G143-F152 WeakPolarHBondContact O-CA 3.28Å; G143-G153 PolarHBondContact N-O 3.38Å; G143-G153 PolarHBondContact O-N 2.66Å
144	R	96.1	Very high	94.1	Very high	4 Å²	4	41.8 Å²	41.8	2%	0.015	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	154.7	174.3	69	-179.9	-166.6	81.4	0.9	110.4	I130 H131 E151 A373 L374	I130-R144 CarbonylContact C-O 3.47Å; I130-R144 WeakPolarHBondContact CA-O 3.44Å; I130-R144 WeakPolarHBondContact CG2-O 3.4Å; H131-R144 HydrophobicContact CB-CG 4.27Å; H131-R144 PolarHBondContact N-O 2.89Å; H131-R144 PolarHBondContact O-N 2.94Å; R144-E151 WeakPolarHBondContact CB-O 3.43Å; R144-A373 VanDerWaalsContact CZ-O 3.28Å; R144-A373 PolarHBondContact NH1-O 2.66Å; R144-A373 PolarHBondContact NH2-O 2.94Å; R144-L374 PolarHBondContact NH2-O 3.49Å
145	I	95.8	Very high	94.1	Very high	14 Å²	14	40.7 Å²	40.7	7%	0.072	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	143.4	168.3	-57.7	179.1	0	0	0	108.5	I122 S123 F124 F129 R147 S150	I122-I145 HydrophobicContact CG2-CD1 3.55Å; I122-I145 HydrophobicContact CG2-CG1 3.45Å; I122-I145 VanDerWaalsContact CG2-CG1 3.45Å; S123-I145 VanDerWaalsContact O-CD1 3.3Å; S123-I145 WeakPolarHBondContact O-CD1 3.35Å; F124-I145 HydrophobicContact CB-CD1 4.11Å; F129-I145 WeakPolarHBondContact O-CA 3.07Å; I145-R147 HydrophobicContact CG2-CB 4.18Å; I145-R147 PolarHBondContact O-N 2.97Å; I145-S150 PolarHBondContact N-OG 3.2Å; I145-S150 VanDerWaalsContact O-CB 3.28Å; I145-S150 WeakPolarHBondContact O-CB 3.47Å; I145-S150 PolarHBondContact O-OG 3.36Å
146	V	95.1	Very high	94.1	Very high	25 Å²	25	34.3 Å²	34.3	15%	0.152	17%	0.171	C	C	.	.	S	Bend	trans	-77.4	77.9	173.6	-173.5	0	0	0	0	108.9	F129 H131 Y370 A373 L374	F129-V146 HydrophobicContact CB-CB 3.98Å; F129-V146 HydrophobicContact CB-CG2 3.91Å; F129-V146 PolarHBondContact O-N 3.08Å; H131-V146 WeakPolarHBondContact CD2-CG2 3.38Å; H131-V146 VanDerWaalsContact NE2-CG2 3.26Å; H131-V146 WeakPolarHBondContact NE2-CG2 3.43Å; V146-Y370 HydrophobicContact CG1-CE2 4.22Å; V146-A373 HydrophobicContact CG1-CB 4.28Å; V146-L374 HydrophobicContact CG1-CD2 3.95Å; V146-L374 HydrophobicContact CG1-CG 4.49Å
147	R	90.5	Very high	94	Very high	134 Å²	134	32.3 Å²	32.3	51%	0.506	16%	0.163	S	C	.	.	S	Bend	trans	-146.6	147.6	177.6	-168.6	176.7	-62.5	164.5	5	108.8	D128 I145 H149 S150	D128-R147 IonicContact OD1-NH2 2.91Å; D128-R147 PolarHBondContact OD1-NH2 2.88Å; D128-R147 VanDerWaalsContact OD1-NH2 3.15Å; D128-R147 IonicContact OD2-NH2 3.26Å; I145-R147 HydrophobicContact CG2-CB 4.18Å; I145-R147 PolarHBondContact O-N 2.97Å; R147-H149 PolarHBondContact O-N 3.44Å; R147-S150 WeakPolarHBondContact O-CB 3.36Å; R147-S150 PolarHBondContact O-N 2.66Å
148	S	84.4	Confident	93.9	Very high	46 Å²	46	32 Å²	32	32%	0.322	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	137.8	175.1	-49.9	0	0	0	0	110.4	S150	S148-S150 PolarHBondContact O-N 3.41Å; S148-S150 VanDerWaalsContact O-N 3.14Å
149	H	83	Confident	93.6	Very high	147 Å²	147	36 Å²	36	68%	0.681	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.5	14.6	-179.6	-37.5	94.3	0	0	0	115.6	R147 E151	R147-H149 PolarHBondContact O-N 3.44Å; H149-E151 PolarHBondContact O-N 3.33Å
150	S	89.4	Confident	93.4	Very high	29 Å²	29	34.6 Å²	34.6	20%	0.203	17%	0.165	C	C	.	.	P	Polyproline II helix	trans	-71.1	128	172.2	-179.5	0	0	0	0	110.7	I145 R147 S148	I145-S150 PolarHBondContact N-OG 3.2Å; I145-S150 VanDerWaalsContact O-CB 3.28Å; I145-S150 WeakPolarHBondContact O-CB 3.47Å; I145-S150 PolarHBondContact O-OG 3.36Å; R147-S150 WeakPolarHBondContact O-CB 3.36Å; R147-S150 PolarHBondContact O-N 2.66Å; S148-S150 PolarHBondContact O-N 3.41Å; S148-S150 VanDerWaalsContact O-N 3.14Å
151	E	91.8	Very high	93	Very high	79 Å²	79	35.3 Å²	35.3	37%	0.369	17%	0.168	S	C	.	.	P	Polyproline II helix	trans	-82.2	168	173.9	-64.4	-161.5	-175.6	0	0	112.6	R144 H149 K379	R144-E151 WeakPolarHBondContact CB-O 3.43Å; H149-E151 PolarHBondContact O-N 3.33Å; E151-K379 WeakPolarHBondContact OE1-CE 3.45Å; E151-K379 IonicContact OE1-NZ 3.16Å; E151-K379 PolarHBondContact OE1-NZ 3.35Å
152	F	95.1	Very high	92.2	Very high	5 Å²	5	35.1 Å²	35.1	2%	0.022	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-75.8	143.6	170.7	-84	-105.8	0	0	0	110.4	L89 K93 H133 I142 G143 Y376	L89-F152 HydrophobicContact CD2-CB 4.45Å; L89-F152 HydrophobicContact CG-CB 4.32Å; K93-F152 HydrophobicContact CB-CE2 4.38Å; K93-F152 HydrophobicContact CG-CB 4.39Å; K93-F152 HydrophobicContact CG-CD2 3.76Å; K93-F152 HydrophobicContact CG-CE2 4.11Å; K93-F152 HydrophobicContact CG-CG 4.01Å; H133-F152 HydrophobicContact CB-CE1 4.17Å; H133-F152 AromaticContact CD2-CE1 3.62Å; H133-F152 AromaticContact CD2-CZ 3.75Å; H133-F152 AromaticContact CE1-CE1 3.6Å; H133-F152 AromaticContact CE1-CZ 3.64Å; H133-F152 AromaticContact CG-CE1 3.54Å; H133-F152 AromaticContact ND1-CE1 3.53Å; H133-F152 AromaticContact NE2-CE1 3.67Å; H133-F152 AromaticContact NE2-CZ 3.44Å; H133-F152 WeakPolarHBondContact NE2-CZ 3.39Å; I142-F152 HydrophobicContact CG2-CD1 4.19Å; G143-F152 CarbonylContact O-C 3.57Å; G143-F152 VanDerWaalsContact O-CA 3.31Å; G143-F152 WeakPolarHBondContact O-CA 3.28Å; F152-Y376 AromaticContact CD2-CD2 3.74Å; F152-Y376 HydrophobicContact CD2-CD2 3.74Å; F152-Y376 AromaticContact CD2-CE2 3.77Å; F152-Y376 HydrophobicContact CD2-CE2 3.77Å; F152-Y376 HydrophobicContact CD2-CG 4.14Å; F152-Y376 AromaticContact CE2-CD1 3.96Å; F152-Y376 HydrophobicContact CE2-CD1 3.96Å; F152-Y376 AromaticContact CE2-CD2 3.57Å; F152-Y376 HydrophobicContact CE2-CD2 3.57Å; F152-Y376 HydrophobicContact CE2-CE1 4.39Å; F152-Y376 HydrophobicContact CE2-CE2 4.03Å; F152-Y376 AromaticContact CE2-CG 3.53Å; F152-Y376 HydrophobicContact CE2-CG 3.53Å
153	G	96.3	Very high	90.8	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.01	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	-178	179.1	0	0	0	0	0	112.9	H120 I142 G143	H120-G153 CarbonylContact O-C 3.35Å; H120-G153 WeakPolarHBondContact O-CA 2.92Å; I142-G153 WeakPolarHBondContact CA-O 3.38Å; G143-G153 PolarHBondContact N-O 3.38Å; G143-G153 PolarHBondContact O-N 2.66Å
154	F	97.6	Very high	89.4	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	127.9	179.9	-65.4	-89	0	0	0	110.2	A85 L89 P116 L117 H120 I122 F136 W140 W141 I142	A85-F154 HydrophobicContact CB-CE1 4.32Å; A85-F154 HydrophobicContact CB-CE2 4.46Å; A85-F154 HydrophobicContact CB-CZ 3.69Å; L89-F154 HydrophobicContact CD1-CD2 4.34Å; L89-F154 HydrophobicContact CD1-CE2 3.74Å; L89-F154 HydrophobicContact CD1-CZ 4.42Å; P116-F154 HydrophobicContact CB-CD1 4.33Å; P116-F154 HydrophobicContact CB-CE1 4.06Å; P116-F154 HydrophobicContact CB-CZ 4.28Å; P116-F154 HydrophobicContact CG-CD1 3.89Å; P116-F154 HydrophobicContact CG-CE1 4.02Å; P116-F154 HydrophobicContact CG-CG 4.42Å; L117-F154 HydrophobicContact CB-CD2 4.04Å; L117-F154 HydrophobicContact CB-CE2 3.7Å; L117-F154 HydrophobicContact CD1-CE2 3.6Å; L117-F154 HydrophobicContact CD1-CZ 4.04Å; L117-F154 HydrophobicContact CG-CE2 3.94Å; L117-F154 HydrophobicContact CG-CZ 4.44Å; H120-F154 HydrophobicContact CB-CD2 4.19Å; H120-F154 HydrophobicContact CB-CE2 4.35Å; H120-F154 PolarHBondContact O-N 3.03Å; I122-F154 PolarHBondContact N-O 3.44Å; F136-F154 HydrophobicContact CB-CD1 4.49Å; F136-F154 HydrophobicContact CB-CE1 4.16Å; F136-F154 HydrophobicContact CD1-CD1 4.35Å; F136-F154 AromaticContact CD1-CE1 3.9Å; F136-F154 HydrophobicContact CD1-CE1 3.9Å; F136-F154 HydrophobicContact CD2-CE1 4.17Å; F136-F154 HydrophobicContact CE1-CE1 4.34Å; F136-F154 HydrophobicContact CG-CD1 4.44Å; F136-F154 AromaticContact CG-CE1 3.81Å; F136-F154 HydrophobicContact CG-CE1 3.81Å; W140-F154 HydrophobicContact CB-CD1 4.15Å; W140-F154 HydrophobicContact CD2-CB 4.28Å; W140-F154 HydrophobicContact CE3-CB 3.64Å; W140-F154 HydrophobicContact CZ3-CB 4.01Å; W141-F154 WeakPolarHBondContact O-CA 3.31Å; I142-F154 HydrophobicContact CD1-CE1 4.11Å; I142-F154 HydrophobicContact CD1-CZ 4.45Å; I142-F154 HydrophobicContact CG1-CD1 4.15Å; I142-F154 HydrophobicContact CG1-CE1 3.93Å
155	V	97.3	Very high	87.7	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	125.6	177.6	-177	0	0	0	0	107.7	I122 F124 I130 I132 W141 Y192	I122-V155 HydrophobicContact CB-CG2 4.33Å; I122-V155 HydrophobicContact CD1-CG2 3.77Å; I122-V155 HydrophobicContact CG1-CG2 4.48Å; F124-V155 HydrophobicContact CE1-CG1 4.38Å; I130-V155 HydrophobicContact CD1-CG1 4.4Å; I130-V155 HydrophobicContact CG2-CG1 4.3Å; I130-V155 HydrophobicContact CG2-CG2 3.88Å; I132-V155 HydrophobicContact CD1-CB 4.08Å; I132-V155 HydrophobicContact CD1-CG1 3.99Å; I132-V155 HydrophobicContact CD1-CG2 4.12Å; W141-V155 HydrophobicContact CB-CB 4.33Å; W141-V155 PolarHBondContact N-O 2.69Å; W141-V155 PolarHBondContact O-N 3.19Å; V155-Y192 WeakPolarHBondContact CG1-OH 3.25Å
156	P	95.9	Very high	85.8	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	137.4	-178.7	30.3	-36.6	0	0	0	110.1	Y107 F124 W140 R160 L161 Y192	Y107-P156 HydrophobicContact CD1-CG 3.84Å; Y107-P156 HydrophobicContact CD2-CG 4.12Å; Y107-P156 HydrophobicContact CE1-CG 3.65Å; Y107-P156 HydrophobicContact CE2-CB 4.4Å; Y107-P156 HydrophobicContact CE2-CG 3.93Å; Y107-P156 HydrophobicContact CG-CG 4.07Å; F124-P156 HydrophobicContact CE1-CG 4.12Å; F124-P156 HydrophobicContact CZ-CG 4.26Å; W140-P156 HydrophobicContact CE3-CB 4.24Å; W140-P156 HydrophobicContact CH2-CB 4.48Å; W140-P156 HydrophobicContact CZ3-CB 3.95Å; W140-P156 HydrophobicContact CZ3-CG 4.47Å; P156-R160 HydrophobicContact CB-CB 4.26Å; P156-R160 HydrophobicContact CB-CG 4.26Å; P156-L161 HydrophobicContact CB-CD2 3.94Å; P156-L161 HydrophobicContact CB-CG 4Å; P156-L161 HydrophobicContact CG-CD1 4.15Å; P156-L161 HydrophobicContact CG-CD2 3.69Å; P156-L161 HydrophobicContact CG-CG 3.93Å; P156-Y192 WeakPolarHBondContact CG-OH 3.43Å; P156-Y192 WeakPolarHBondContact O-CE2 3.47Å; P156-Y192 VanDerWaalsContact O-CZ 3.31Å; P156-Y192 PolarHBondContact O-OH 2.86Å
157	T	95.1	Very high	83.7	Confident	7 Å²	7	54 Å²	54	4%	0.043	28%	0.281	C	S	.	.			trans	-72	161.3	175.2	65	0	0	0	0	110.8	S138 D139 W141 R159 R160 L161	S138-T157 PolarHBondContact O-OG1 3.4Å; D139-T157 WeakPolarHBondContact CA-OG1 3.36Å; D139-T157 PolarHBondContact O-N 3.21Å; D139-T157 PolarHBondContact O-OG1 3.41Å; W141-T157 HydrophobicContact CD2-CG2 3.91Å; W141-T157 HydrophobicContact CG-CG2 3.9Å; W141-T157 HydrophobicContact CZ2-CG2 4.29Å; T157-R159 PolarHBondContact O-N 3.22Å; T157-R159 VanDerWaalsContact O-N 3.16Å; T157-R160 WeakPolarHBondContact O-CA 3.44Å; T157-R160 WeakPolarHBondContact O-CB 3.26Å; T157-R160 PolarHBondContact O-N 3.22Å; T157-R160 PolarHBondContact OG1-N 3.18Å; T157-L161 PolarHBondContact O-N 2.79Å
158	A	91.6	Very high	81.8	Confident	38 Å²	38	53.5 Å²	53.5	31%	0.314	29%	0.288	S	S	.	.	H	α-helix	trans	-54.3	-36.2	174.2	0	0	0	0	0	112.3	R160 L161 A162 P191 Y192	A158-R160 VanDerWaalsContact C-N 3.33Å; A158-R160 PolarHBondContact O-N 2.89Å; A158-L161 PolarHBondContact O-N 2.89Å; A158-A162 WeakPolarHBondContact O-CB 3.33Å; A158-A162 PolarHBondContact O-N 2.62Å; A158-P191 HydrophobicContact CB-CG 3.93Å; A158-Y192 HydrophobicContact CB-CD2 4.34Å
159	R	88.6	Confident	80.1	Confident	138 Å²	138	57.7 Å²	57.7	52%	0.521	30%	0.303	S	S	.	.	H	α-helix	trans	-61.1	-41.1	174.7	-171.9	-179.6	81.4	149.1	15.2	112.3	S138 D139 T157	S138-R159 PolarHBondContact O-NE 3.1Å; D139-R159 VanDerWaalsContact CG-NH2 3.3Å; D139-R159 IonicContact OD1-CZ 2.87Å; D139-R159 VanDerWaalsContact OD1-CZ 3.3Å; D139-R159 IonicContact OD1-NE 3.69Å; D139-R159 PolarHBondContact OD1-NE 2.93Å; D139-R159 IonicContact OD1-NH2 3.06Å; D139-R159 PolarHBondContact OD1-NH2 3.34Å; D139-R159 IonicContact OD2-NH2 3.3Å; D139-R159 PolarHBondContact OD2-NH2 3.44Å; T157-R159 PolarHBondContact O-N 3.22Å; T157-R159 VanDerWaalsContact O-N 3.16Å
160	R	88.9	Confident	78	Confident	13 Å²	13	58 Å²	58	5%	0.049	31%	0.309	C	S	.	.	H	α-helix	trans	-68	-46	178.1	-173.3	-178.9	-172.8	87.1	-3.8	111.1	D112 K114 D139 W140 P156 T157 A158 A162 N163 Y164	D112-R160 IonicContact OD1-CZ 2.77Å; D112-R160 IonicContact OD1-NE 2.7Å; D112-R160 IonicContact OD1-NH2 3.34Å; D112-R160 PolarHBondContact OD1-NH2 3.05Å; D112-R160 IonicContact OD2-CZ 2.72Å; D112-R160 VanDerWaalsContact OD2-CZ 3.26Å; D112-R160 IonicContact OD2-NE 2.75Å; D112-R160 PolarHBondContact OD2-NE 3.44Å; D112-R160 IonicContact OD2-NH2 3.92Å; D112-R160 PolarHBondContact OD2-NH2 2.93Å; K114-R160 PolarHBondContact O-NH2 2.88Å; D139-R160 HydrophobicContact CB-CB 4.04Å; D139-R160 HydrophobicContact CB-CG 4.19Å; D139-R160 WeakPolarHBondContact O-CB 3.41Å; D139-R160 VanDerWaalsContact O-CD 3.31Å; D139-R160 WeakPolarHBondContact O-CD 3.42Å; W140-R160 VanDerWaalsContact CE2-NE 3.33Å; P156-R160 HydrophobicContact CB-CB 4.26Å; P156-R160 HydrophobicContact CB-CG 4.26Å; T157-R160 WeakPolarHBondContact O-CA 3.44Å; T157-R160 WeakPolarHBondContact O-CB 3.26Å; T157-R160 PolarHBondContact O-N 3.22Å; T157-R160 PolarHBondContact OG1-N 3.18Å; A158-R160 VanDerWaalsContact C-N 3.33Å; A158-R160 PolarHBondContact O-N 2.89Å; R160-A162 VanDerWaalsContact C-N 3.31Å; R160-A162 PolarHBondContact O-N 3.18Å; R160-N163 WeakPolarHBondContact O-CB 3.45Å; R160-N163 PolarHBondContact O-N 3.22Å; R160-Y164 HydrophobicContact CG-CE2 4.43Å
161	L	87.4	Confident	75.7	Confident	16 Å²	16	62.1 Å²	62.1	8%	0.084	34%	0.336	C	S	.	.	H	α-helix	trans	-63.9	-35.6	179.5	-70.7	-178.4	0	0	0	112.3	Y107 F124 P156 T157 A158 N163 Y164 M165 P191 Y192	Y107-L161 HydrophobicContact CD2-CD2 3.54Å; Y107-L161 HydrophobicContact CE2-CD2 3.96Å; Y107-L161 HydrophobicContact CG-CD2 4.21Å; F124-L161 HydrophobicContact CZ-CD1 4.35Å; P156-L161 HydrophobicContact CB-CD2 3.94Å; P156-L161 HydrophobicContact CB-CG 4Å; P156-L161 HydrophobicContact CG-CD1 4.15Å; P156-L161 HydrophobicContact CG-CD2 3.69Å; P156-L161 HydrophobicContact CG-CG 3.93Å; T157-L161 PolarHBondContact O-N 2.79Å; A158-L161 PolarHBondContact O-N 2.89Å; L161-N163 PolarHBondContact O-N 3.22Å; L161-N163 VanDerWaalsContact O-N 3.1Å; L161-Y164 HydrophobicContact CD2-CD2 4.44Å; L161-Y164 WeakPolarHBondContact O-CB 3.42Å; L161-Y164 PolarHBondContact O-N 3.41Å; L161-M165 WeakPolarHBondContact O-CG 3.3Å; L161-M165 PolarHBondContact O-N 2.93Å; L161-P191 HydrophobicContact CB-CB 4.13Å; L161-P191 HydrophobicContact CB-CG 3.87Å; L161-P191 HydrophobicContact CD1-CB 3.52Å; L161-P191 HydrophobicContact CD1-CG 3.75Å; L161-P191 HydrophobicContact CG-CB 4.49Å; L161-P191 HydrophobicContact CG-CG 4.45Å; L161-Y192 HydrophobicContact CD1-CE1 4.38Å; L161-Y192 HydrophobicContact CD1-CE2 3.66Å; L161-Y192 WeakPolarHBondContact CD1-OH 3.28Å
162	A	80.6	Confident	73.3	Confident	41 Å²	41	63.1 Å²	63.1	34%	0.339	35%	0.349	S	S	.	.	H	α-helix	trans	-53.8	-31.8	175.2	0	0	0	0	0	113.5	A158 R160 Y164 M165	A158-A162 WeakPolarHBondContact O-CB 3.33Å; A158-A162 PolarHBondContact O-N 2.62Å; R160-A162 VanDerWaalsContact C-N 3.31Å; R160-A162 PolarHBondContact O-N 3.18Å; A162-Y164 VanDerWaalsContact C-N 3.29Å; A162-Y164 PolarHBondContact O-N 2.91Å; A162-M165 PolarHBondContact O-N 2.75Å
163	N	69.2	Low	70.7	Confident	106 Å²	106	69 Å²	69	57%	0.567	39%	0.385	S	S	*	.	H	α-helix	trans	-68.7	-27.4	177	-60.8	-30.9	0	0	0	112.9	R160 L161 S167	R160-N163 WeakPolarHBondContact O-CB 3.45Å; R160-N163 PolarHBondContact O-N 3.22Å; L161-N163 PolarHBondContact O-N 3.22Å; L161-N163 VanDerWaalsContact O-N 3.1Å; N163-S167 PolarHBondContact O-OG 2.9Å
164	Y	66.9	Low	67.9	Low	100 Å²	100	78.1 Å²	78.1	39%	0.392	42%	0.424	S	S	.	.	H	α-helix	trans	-81.9	-27	173.7	-64.2	-76.9	0	0	0	111.7	D112 R160 L161 A162 V166 S167	D112-Y164 PolarHBondContact OD1-OH 3.4Å; D112-Y164 PolarHBondContact OD2-OH 3.39Å; R160-Y164 HydrophobicContact CG-CE2 4.43Å; L161-Y164 HydrophobicContact CD2-CD2 4.44Å; L161-Y164 WeakPolarHBondContact O-CB 3.42Å; L161-Y164 PolarHBondContact O-N 3.41Å; A162-Y164 VanDerWaalsContact C-N 3.29Å; A162-Y164 PolarHBondContact O-N 2.91Å; Y164-V166 VanDerWaalsContact C-N 3.27Å; Y164-V166 PolarHBondContact O-N 3.06Å; Y164-S167 PolarHBondContact O-N 3.46Å
165	M	60.7	Low	65.1	Low	24 Å²	24	86.4 Å²	86.4	12%	0.118	46%	0.463	C	S	.	.	H	α-helix	trans	-68.3	-23.2	180	-57.1	175.5	83.8	0	0	113.6	L161 A162 P188 K189	L161-M165 WeakPolarHBondContact O-CG 3.3Å; L161-M165 PolarHBondContact O-N 2.93Å; A162-M165 PolarHBondContact O-N 2.75Å; M165-P188 HydrophobicContact CB-CB 4.45Å; M165-P188 HydrophobicContact CE-CB 3.3Å; M165-P188 HydrophobicContact SD-CB 3.88Å; M165-K189 WeakPolarHBondContact CE-O 3.31Å
166	V	56	Low	62.4	Low	113 Å²	113	93.8 Å²	93.8	69%	0.685	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-17	179.6	180	0	0	0	0	112.1	Y164	Y164-V166 VanDerWaalsContact C-N 3.27Å; Y164-V166 PolarHBondContact O-N 3.06Å
167	S	51.5	Low	59.5	Low	97 Å²	97	100.4 Å²	100.4	68%	0.678	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-14.3	-173.3	-53.8	0	0	0	0	114.2	N163 Y164	N163-S167 PolarHBondContact O-OG 2.9Å; Y164-S167 PolarHBondContact O-N 3.46Å
168	D	50.1	Low	57	Low	123 Å²	123	105.5 Å²	105.5	66%	0.658	58%	0.579	S	S	*	*	S	Bend	trans	-94.1	-5.5	-178	-80.4	-18.6	0	0	0	114	R105	R105-D168 IonicContact NH2-OD2 3.87Å
169	E	48.1	Very low	54.4	Low	135 Å²	135	110.9 Å²	110.9	63%	0.631	60%	0.602	S	S	*	*	S	Bend	trans	-108.2	116.5	-175.6	-64.7	-83.5	147.9	0	0	110.6
170	D	40.7	Very low	52.2	Low	152 Å²	152	113.5 Å²	113.5	81%	0.813	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-57.3	142.7	168.4	-79.3	-46.2	0	0	0	110.9
171	P	40.5	Very low	49.9	Very low	116 Å²	116	121.7 Å²	121.7	75%	0.753	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-68.2	133.2	-178	26.7	-32.6	0	0	0	111.7
172	P	40.2	Very low	47.6	Very low	100 Å²	100	125.6 Å²	125.6	65%	0.649	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-76.8	136.3	-178.6	28.6	-31.5	0	0	0	112	K174	P172-K174 PolarHBondContact O-N 2.79Å
173	V	41.8	Very low	45.4	Very low	130 Å²	130	134.5 Å²	134.5	79%	0.788	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-57.5	126.9	168.4	178.5	0	0	0	0	109.6	H175	V173-H175 PolarHBondContact O-N 2.79Å
174	K	38	Very low	44.2	Very low	191 Å²	191	134.5 Å²	134.5	83%	0.83	71%	0.713	S	S	*	*			trans	-67.9	109.2	-179.9	-66.1	178.1	179.9	177.4	0	110.9	P172	P172-K174 PolarHBondContact O-N 2.79Å
175	H	38.2	Very low	43.1	Very low	175 Å²	175	134.8 Å²	134.8	81%	0.81	72%	0.72	S	S	*	*			trans	-108.6	121.8	157.3	-96	-71.4	0	0	0	110.2	V173 T177	V173-H175 PolarHBondContact O-N 2.79Å; H175-T177 PolarHBondContact O-N 2.92Å
176	N	39.8	Very low	42.4	Very low	155 Å²	155	141.7 Å²	141.7	83%	0.829	75%	0.745	S	S	*	*			trans	-80.3	108.6	177.5	-71.3	-24.3	0	0	0	109.9
177	T	35.2	Very low	41.9	Very low	138 Å²	138	144 Å²	144	85%	0.847	75%	0.749	S	S	*	*			trans	-147.5	129.6	154.3	35.9	0	0	0	0	109.9	H175 D179	H175-T177 PolarHBondContact O-N 2.92Å; T177-D179 PolarHBondContact O-N 2.95Å
178	S	43.4	Very low	42.1	Very low	114 Å²	114	143.5 Å²	143.5	80%	0.797	74%	0.743	S	S	*	*			trans	-74	108	178.5	48.9	0	0	0	0	110.8
179	D	35.5	Very low	42.9	Very low	151 Å²	151	145.9 Å²	145.9	81%	0.807	75%	0.747	S	S	*	*			trans	-147.9	127.6	157.4	-95.1	-34.2	0	0	0	110.9	T177 Q181	T177-D179 PolarHBondContact O-N 2.95Å; D179-Q181 PolarHBondContact O-N 3.35Å; D179-Q181 VanDerWaalsContact O-N 3.13Å
180	H	43.8	Very low	44.5	Very low	194 Å²	194	143.7 Å²	143.7	90%	0.898	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	25.4	-171	-94.8	-67.2	0	0	0	114.3
181	Q	40	Very low	46.8	Very low	184 Å²	184	136.9 Å²	136.9	86%	0.86	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.8	16.2	-172.2	-146.4	161.6	8.6	0	0	115.6	D179	D179-Q181 PolarHBondContact O-N 3.35Å; D179-Q181 VanDerWaalsContact O-N 3.13Å
182	D	38.4	Very low	49.4	Very low	99 Å²	99	132.2 Å²	132.2	53%	0.529	68%	0.678	S	S	.	*			trans	-128	36.1	-176.8	-142	6.9	0	0	0	114.8	S184 I185	D182-S184 VanDerWaalsContact C-N 3.26Å; D182-I185 WeakPolarHBondContact OD1-CD1 3.29Å; D182-I185 VanDerWaalsContact OD1-CG1 3.32Å; D182-I185 WeakPolarHBondContact OD1-CG1 3.37Å; D182-I185 WeakPolarHBondContact OD2-CD1 3.13Å
183	R	36	Very low	51.9	Low	227 Å²	227	129.9 Å²	129.9	86%	0.857	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-0.7	170	-74.5	-166.1	177.2	-173	0.4	113.9
184	S	42.2	Very low	54.4	Low	107 Å²	107	127.5 Å²	127.5	75%	0.748	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-12.3	-179.4	-179.8	0	0	0	0	114.2	D182 W186	D182-S184 VanDerWaalsContact C-N 3.26Å; S184-W186 VanDerWaalsContact C-N 3.35Å
185	I	44.7	Very low	57.2	Low	105 Å²	105	118.6 Å²	118.6	54%	0.538	60%	0.604	S	S	.	*	S	Bend	trans	-78	-19.6	-177.5	-73.6	-179.2	0	0	0	112.4	D182	D182-I185 WeakPolarHBondContact OD1-CD1 3.29Å; D182-I185 VanDerWaalsContact OD1-CG1 3.32Å; D182-I185 WeakPolarHBondContact OD1-CG1 3.37Å; D182-I185 WeakPolarHBondContact OD2-CD1 3.13Å
186	W	45.8	Very low	59.9	Low	170 Å²	170	110.4 Å²	110.4	64%	0.644	57%	0.566	S	S	*	*	S	Bend	trans	-124.8	23.1	-165.4	-56.4	100.5	0	0	0	115.8	S184 P188	S184-W186 VanDerWaalsContact C-N 3.35Å; W186-P188 WeakPolarHBondContact O-CD 3.43Å
187	E	45.8	Very low	62.6	Low	162 Å²	162	103.6 Å²	103.6	76%	0.757	53%	0.531	S	S	*	.	S	Bend	trans	-90.7	114.7	165.4	-90.1	175.5	178.7	0	0	109.4	K189	E187-K189 PolarHBondContact O-N 3.43Å
188	P	55.3	Low	65.4	Low	86 Å²	86	97 Å²	97	56%	0.558	49%	0.491	S	S	*	.			trans	-57.9	115.9	176.5	-19.5	30.1	0	0	0	109	M165 W186 C190	M165-P188 HydrophobicContact CB-CB 4.45Å; M165-P188 HydrophobicContact CE-CB 3.3Å; M165-P188 HydrophobicContact SD-CB 3.88Å; W186-P188 WeakPolarHBondContact O-CD 3.43Å; P188-C190 PolarHBondContact O-N 3.05Å
189	K	66.9	Low	67.9	Low	173 Å²	173	93.3 Å²	93.3	75%	0.752	46%	0.459	S	S	*	.			trans	-52.5	130.6	178.1	-74.3	-179.7	-180	172	0	109.3	M165 E187	M165-K189 WeakPolarHBondContact CE-O 3.31Å; E187-K189 PolarHBondContact O-N 3.43Å
190	C	81.9	Confident	70.8	Confident	89 Å²	89	86.1 Å²	86.1	60%	0.601	42%	0.421	S	S	*	.			trans	-47.1	129.5	178	-74.4	0	0	0	0	110.4	P188 Y192	P188-C190 PolarHBondContact O-N 3.05Å; C190-Y192 PolarHBondContact O-N 2.86Å; C190-Y192 VanDerWaalsContact O-N 3.08Å
191	P	89.9	Confident	73.4	Confident	8 Å²	8	77 Å²	77	5%	0.052	38%	0.379	C	S	.	.	S	Bend	trans	-69.7	-10.4	-174.8	27.9	-35.6	0	0	0	113.1	M104 A158 L161	M104-P191 PolarHBondContact N-O 2.77Å; A158-P191 HydrophobicContact CB-CG 3.93Å; L161-P191 HydrophobicContact CB-CB 4.13Å; L161-P191 HydrophobicContact CB-CG 3.87Å; L161-P191 HydrophobicContact CD1-CB 3.52Å; L161-P191 HydrophobicContact CD1-CG 3.75Å; L161-P191 HydrophobicContact CG-CB 4.49Å; L161-P191 HydrophobicContact CG-CG 4.45Å
192	Y	94	Very high	76	Confident	19 Å²	19	68.4 Å²	68.4	8%	0.075	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	139.1	179.1	-61	-61.4	0	0	0	110.5	V101 Q102 F124 I130 W141 V155 P156 A158 L161 C190	V101-Y192 HydrophobicContact CB-CD1 4.21Å; V101-Y192 HydrophobicContact CB-CG 4.34Å; V101-Y192 HydrophobicContact CG2-CD1 3.77Å; V101-Y192 HydrophobicContact CG2-CE1 4.28Å; V101-Y192 HydrophobicContact CG2-CG 4.22Å; Q102-Y192 WeakPolarHBondContact O-CA 3.38Å; F124-Y192 HydrophobicContact CE1-CE1 4.42Å; F124-Y192 HydrophobicContact CE2-CE1 4.07Å; F124-Y192 AromaticContact CZ-CE1 3.71Å; F124-Y192 HydrophobicContact CZ-CE1 3.71Å; F124-Y192 AromaticContact CZ-CZ 3.88Å; F124-Y192 VanDerWaalsContact CZ-OH 3.27Å; F124-Y192 WeakPolarHBondContact CZ-OH 3.2Å; I130-Y192 HydrophobicContact CD1-CE1 4.25Å; W141-Y192 HydrophobicContact CH2-CD2 4.45Å; W141-Y192 HydrophobicContact CZ3-CD2 4.01Å; W141-Y192 HydrophobicContact CZ3-CE2 4.02Å; V155-Y192 WeakPolarHBondContact CG1-OH 3.25Å; P156-Y192 WeakPolarHBondContact CG-OH 3.43Å; P156-Y192 WeakPolarHBondContact O-CE2 3.47Å; P156-Y192 VanDerWaalsContact O-CZ 3.31Å; P156-Y192 PolarHBondContact O-OH 2.86Å; A158-Y192 HydrophobicContact CB-CD2 4.34Å; L161-Y192 HydrophobicContact CD1-CE1 4.38Å; L161-Y192 HydrophobicContact CD1-CE2 3.66Å; L161-Y192 WeakPolarHBondContact CD1-OH 3.28Å; C190-Y192 PolarHBondContact O-N 2.86Å; C190-Y192 VanDerWaalsContact O-N 3.08Å
193	K	93.7	Very high	78.8	Confident	50 Å²	50	64.2 Å²	64.2	22%	0.217	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	121.4	166.8	-179.1	172.8	171.7	179.1	0	108.2	V101 Q102 M104 V195 Q298 L300 P301	V101-K193 CarbonylContact C-O 3.59Å; V101-K193 VanDerWaalsContact CA-O 3.3Å; V101-K193 WeakPolarHBondContact CA-O 3.2Å; Q102-K193 HydrophobicContact CB-CB 4.44Å; Q102-K193 PolarHBondContact N-O 3.47Å; Q102-K193 PolarHBondContact O-N 3.42Å; M104-K193 HydrophobicContact CG-CB 4.12Å; M104-K193 HydrophobicContact SD-CB 3.91Å; K193-V195 HydrophobicContact CG-CG1 4.31Å; K193-Q298 PolarHBondContact NZ-O 3.09Å; K193-L300 WeakPolarHBondContact CE-O 3.44Å; K193-L300 PolarHBondContact NZ-O 3.34Å; K193-P301 VanDerWaalsContact CE-CA 3.43Å
194	V	94.4	Very high	81.6	Confident	80 Å²	80	53.4 Å²	53.4	49%	0.485	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	133.3	176.2	179.6	0	0	0	0	108.8	V101 P301	V101-V194 HydrophobicContact CG1-CG2 4.4Å; V194-P301 WeakPolarHBondContact O-CB 3.31Å
195	V	95.7	Very high	83.9	Confident	4 Å²	4	48.3 Å²	48.3	2%	0.024	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	162.9	-174.2	-66.7	0	0	0	0	110.9	A100 Q102 F129 K193 P301	A100-V195 HydrophobicContact CB-CG2 4.05Å; A100-V195 PolarHBondContact O-N 3.38Å; Q102-V195 HydrophobicContact CB-CG1 3.98Å; Q102-V195 HydrophobicContact CB-CG2 4.39Å; F129-V195 HydrophobicContact CD1-CG2 3.85Å; F129-V195 HydrophobicContact CE1-CB 4.32Å; F129-V195 HydrophobicContact CE1-CG2 3.75Å; K193-V195 HydrophobicContact CG-CG1 4.31Å; V195-P301 WeakPolarHBondContact CA-O 3.35Å
196	P	96.4	Very high	86.2	Confident	3 Å²	3	43.5 Å²	43.5	2%	0.019	22%	0.216	C	C	.	.			trans	-48.6	141.6	169	-31.1	35.6	0	0	0	113	S198 I274 M275 T278 P301 L302	P196-S198 WeakPolarHBondContact CB-O 3.3Å; P196-S198 PolarHBondContact O-N 2.85Å; P196-I274 HydrophobicContact CG-CG2 4.28Å; P196-M275 HydrophobicContact CG-CG 3.89Å; P196-T278 HydrophobicContact CB-CG2 4.33Å; P196-T278 WeakPolarHBondContact CB-OG1 3.46Å; P196-P301 WeakPolarHBondContact CD-O 3.35Å; P196-L302 HydrophobicContact CG-CD2 3.84Å
197	S	94.9	Very high	88.3	Confident	13 Å²	13	35.5 Å²	35.5	9%	0.091	19%	0.186	C	C	.	.	S	Bend	trans	-64.6	-23.3	177.4	-56.2	0	0	0	0	113.4	H131	H131-S197 PolarHBondContact NE2-O 3.03Å
198	S	95.3	Very high	90.4	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.156	C	C	.	.	S	Bend	trans	-129	135.1	163.9	53.1	0	0	0	0	108.3	P196 T278 H282	P196-S198 WeakPolarHBondContact CB-O 3.3Å; P196-S198 PolarHBondContact O-N 2.85Å; S198-T278 VanDerWaalsContact O-CG2 3.25Å; S198-T278 WeakPolarHBondContact O-CG2 3.3Å; S198-T278 WeakPolarHBondContact OG-CB 3.32Å; S198-T278 VanDerWaalsContact OG-CG2 3.28Å; S198-T278 WeakPolarHBondContact OG-CG2 3.42Å; S198-H282 WeakPolarHBondContact CB-O 3.34Å; S198-H282 PolarHBondContact OG-O 3.13Å
199	R	95.7	Very high	92	Very high	35 Å²	35	25.3 Å²	25.3	13%	0.132	13%	0.131	C	C	.	.	P	Polyproline II helix	trans	-67	127.9	-176.2	-64.5	172.2	68.2	-166.1	-1.3	109.1	F129 S303 P304 I305 E348 Y370	F129-R199 HydrophobicContact CD1-CG 4.03Å; F129-R199 HydrophobicContact CE1-CG 3.45Å; F129-R199 VanDerWaalsContact CE1-CG 3.45Å; F129-R199 HydrophobicContact CE2-CG 4.44Å; F129-R199 HydrophobicContact CZ-CG 3.66Å; F129-R199 VanDerWaalsContact CZ-NE 3.27Å; R199-S303 PolarHBondContact NE-O 3.2Å; R199-P304 PolarHBondContact NH2-O 3.27Å; R199-I305 HydrophobicContact CB-CD1 3.76Å; R199-I305 HydrophobicContact CB-CG1 3.75Å; R199-E348 IonicContact CZ-OE1 3.68Å; R199-E348 IonicContact NH1-OE1 3.7Å; R199-E348 PolarHBondContact NH1-OE1 2.96Å; R199-E348 IonicContact NH2-OE1 3.15Å; R199-E348 PolarHBondContact NH2-OE1 3.47Å; R199-Y370 WeakPolarHBondContact CB-OH 3.22Å; R199-Y370 VanDerWaalsContact CG-OH 3.31Å; R199-Y370 WeakPolarHBondContact CG-OH 3.44Å; R199-Y370 PolarHBondContact N-OH 2.9Å
200	P	96.4	Very high	93	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.006	12%	0.118	C	C	.	.	P	Polyproline II helix	trans	-66.7	138.9	176.2	26.4	-31.3	0	0	0	110	I274 V286 L302 P304 I305	P200-I274 HydrophobicContact CB-CG2 4.09Å; P200-I274 HydrophobicContact CG-CG2 4.18Å; P200-V286 HydrophobicContact CB-CG2 3.63Å; P200-L302 WeakPolarHBondContact CD-O 3.44Å; P200-L302 HydrophobicContact CG-CB 4.1Å; P200-P304 HydrophobicContact CG-CB 4.14Å; P200-P304 HydrophobicContact CG-CG 4.31Å; P200-P304 CarbonylContact O-C 3.58Å; P200-P304 VanDerWaalsContact O-CA 3.23Å; P200-P304 WeakPolarHBondContact O-CA 3.36Å; P200-P304 WeakPolarHBondContact O-CB 3.2Å; P200-I305 PolarHBondContact O-N 3.46Å
201	I	97.1	Very high	93.4	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.005	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	127.2	-179.5	-57.7	155.4	0	0	0	108.2	M233 L283 L284 L285 V286 I305 F307 L367	I201-M233 HydrophobicContact CD1-CE 4Å; I201-L283 HydrophobicContact CD1-CB 4.22Å; I201-L283 HydrophobicContact CD1-CD2 4.43Å; I201-L284 PolarHBondContact N-O 3.11Å; I201-L285 HydrophobicContact CB-CD1 4.16Å; I201-L285 HydrophobicContact CG2-CD1 3.8Å; I201-L285 WeakPolarHBondContact O-CA 3.46Å; I201-V286 PolarHBondContact O-N 2.81Å; I201-I305 WeakPolarHBondContact CA-O 3.27Å; I201-I305 HydrophobicContact CG1-CB 4.39Å; I201-I305 HydrophobicContact CG1-CD1 4.48Å; I201-F307 HydrophobicContact CG2-CD2 3.67Å; I201-F307 HydrophobicContact CG2-CE2 3.49Å; I201-F307 VanDerWaalsContact CG2-CE2 3.49Å; I201-F307 HydrophobicContact CG2-CZ 4.49Å; I201-L367 HydrophobicContact CD1-CD1 3.98Å; I201-L367 HydrophobicContact CD1-CD2 3.48Å; I201-L367 VanDerWaalsContact CD1-CD2 3.48Å; I201-L367 HydrophobicContact CD1-CG 4.4Å; I201-L367 HydrophobicContact CG1-CD2 4.05Å
202	V	96.1	Very high	93.4	Very high	4 Å²	4	23.7 Å²	23.7	2%	0.024	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	131.1	179.3	179	0	0	0	0	109.1	L204 V286 I291 P304 I305 F306 F307	V202-L204 HydrophobicContact CG1-CD2 3.9Å; V202-L204 HydrophobicContact CG1-CG 4.4Å; V202-V286 HydrophobicContact CG2-CB 4.31Å; V202-I291 HydrophobicContact CG1-CD1 4.13Å; V202-I291 HydrophobicContact CG1-CG2 4.25Å; V202-I291 HydrophobicContact CG2-CD1 4.29Å; V202-P304 HydrophobicContact CG2-CB 4.05Å; V202-I305 PolarHBondContact N-O 3.35Å; V202-F306 HydrophobicContact CB-CD1 3.87Å; V202-F306 HydrophobicContact CB-CE1 4.02Å; V202-F306 HydrophobicContact CG1-CD1 4.12Å; V202-F306 HydrophobicContact CG1-CE1 4.15Å; V202-F306 HydrophobicContact CG2-CE1 4.41Å; V202-F307 PolarHBondContact O-N 3.21Å
203	L	96.1	Very high	93.4	Very high	11 Å²	11	23.3 Å²	23.3	6%	0.058	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	130.1	173.3	-55.8	-177.8	0	0	0	109.4	Q209 H218 L221 L285 F307 I309	L203-Q209 PolarHBondContact O-NE2 3.21Å; L203-H218 HydrophobicContact CD1-CB 4.33Å; L203-H218 PolarHBondContact O-CE1 3.28Å; L203-H218 VanDerWaalsContact O-CE1 3.25Å; L203-L221 HydrophobicContact CD1-CB 4.43Å; L203-L285 HydrophobicContact CG-CD1 4.31Å; L203-F307 HydrophobicContact CD2-CB 3.94Å; L203-F307 HydrophobicContact CD2-CD2 3.96Å; L203-F307 HydrophobicContact CD2-CG 4.47Å; L203-I309 HydrophobicContact CB-CD1 4.37Å
204	L	94.8	Very high	93.4	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	151.2	179.2	-62	-178.8	0	0	0	111.4	V202 I291 P294 F306 F307 L308 I309 F347	V202-L204 HydrophobicContact CG1-CD2 3.9Å; V202-L204 HydrophobicContact CG1-CG 4.4Å; L204-I291 HydrophobicContact CD2-CG2 3.8Å; L204-I291 WeakPolarHBondContact CD2-O 3.25Å; L204-P294 HydrophobicContact CD1-CG 3.99Å; L204-F306 HydrophobicContact CD1-CB 4.1Å; L204-F306 HydrophobicContact CD1-CD1 3.55Å; L204-F306 HydrophobicContact CD1-CE1 4.22Å; L204-F306 HydrophobicContact CD1-CG 4.03Å; L204-F306 HydrophobicContact CD2-CD1 4.4Å; L204-F306 HydrophobicContact CG-CD1 3.96Å; L204-F307 PolarHBondContact N-O 3.14Å; L204-L308 HydrophobicContact CB-CD1 4.03Å; L204-I309 PolarHBondContact O-N 2.96Å; L204-F347 HydrophobicContact CD1-CD1 4.16Å; L204-F347 HydrophobicContact CD1-CE1 3.74Å
205	G	91.8	Very high	93.3	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.097	C	C	.	.			trans	73.3	-171.4	176.4	0	0	0	0	0	113.6	T207 T214 H218	G205-T207 VanDerWaalsContact C-N 3.35Å; G205-T214 WeakPolarHBondContact O-CG2 3.38Å; G205-H218 PolarHBondContact O-CE1 3.42Å; G205-H218 PolarHBondContact O-NE2 2.97Å
206	P	91.6	Very high	93.2	Very high	4 Å²	4	24.5 Å²	24.5	3%	0.026	11%	0.113	C	C	.	.	S	Bend	cis	-75.5	-16.8	-0.9	31.9	-36.4	0	0	0	114.4	L217 I309 V311 A336	P206-L217 HydrophobicContact CG-CD1 3.67Å; P206-I309 WeakPolarHBondContact CA-O 3.44Å; P206-V311 HydrophobicContact CB-CG2 3.84Å; P206-V311 HydrophobicContact CG-CG2 4.24Å; P206-A336 WeakPolarHBondContact O-CA 3.42Å; P206-A336 VanDerWaalsContact O-CB 3.23Å; P206-A336 WeakPolarHBondContact O-CB 3.35Å
207	T	91.4	Very high	93.1	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.012	13%	0.127	C	C	.	.	S	Bend	trans	-128	-139.5	176.7	69.2	0	0	0	0	110	G205 S211 T214 L317 E332 A336	G205-T207 VanDerWaalsContact C-N 3.35Å; T207-S211 VanDerWaalsContact OG1-CB 3.28Å; T207-S211 WeakPolarHBondContact OG1-CB 3.43Å; T207-S211 PolarHBondContact OG1-OG 2.89Å; T207-T214 PolarHBondContact N-OG1 3.36Å; T207-T214 PolarHBondContact OG1-OG1 2.9Å; T207-L317 HydrophobicContact CG2-CD1 3.78Å; T207-L317 HydrophobicContact CG2-CD2 4.07Å; T207-L317 HydrophobicContact CG2-CG 4.37Å; T207-E332 HydrophobicContact CG2-CB 4.05Å; T207-E332 WeakPolarHBondContact CG2-O 3.22Å; T207-E332 PolarHBondContact OG1-OE2 2.96Å; T207-A336 HydrophobicContact CG2-CB 4.12Å
208	L	88.9	Confident	93.1	Very high	26 Å²	26	26.9 Å²	26.9	14%	0.136	12%	0.124	C	C	.	.			trans	-65.4	142.7	171.9	-71.3	166.7	0	0	0	110.7	H210 S211 T214 E332 V335	L208-H210 VanDerWaalsContact C-N 3.27Å; L208-H210 PolarHBondContact O-N 2.97Å; L208-S211 WeakPolarHBondContact O-CB 3.27Å; L208-S211 PolarHBondContact O-N 2.89Å; L208-T214 VanDerWaalsContact O-CB 3.24Å; L208-T214 WeakPolarHBondContact O-CB 3.47Å; L208-T214 PolarHBondContact O-OG1 3.24Å; L208-E332 HydrophobicContact CD1-CG 4.07Å; L208-V335 HydrophobicContact CD2-CB 4.38Å; L208-V335 HydrophobicContact CD2-CG1 4.23Å; L208-V335 HydrophobicContact CD2-CG2 3.72Å; L208-V335 HydrophobicContact CG-CB 4.33Å; L208-V335 HydrophobicContact CG-CG1 4.4Å; L208-V335 HydrophobicContact CG-CG2 3.99Å
209	Q	88	Confident	93.2	Very high	9 Å²	9	29.8 Å²	29.8	4%	0.042	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-36.4	179.5	-71.3	-64.7	-3.2	0	0	113	L203 S211 H218 I291	L203-Q209 PolarHBondContact O-NE2 3.21Å; Q209-S211 PolarHBondContact O-N 2.89Å; Q209-H218 PolarHBondContact OE1-CE1 3.38Å; Q209-H218 PolarHBondContact OE1-ND1 2.72Å; Q209-I291 WeakPolarHBondContact CG-O 3.47Å; Q209-I291 PolarHBondContact NE2-O 3.14Å
210	H	87.7	Confident	93.2	Very high	101 Å²	101	29.8 Å²	29.8	47%	0.468	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	2.8	176.9	66.1	62.1	0	0	0	113.2	L208	L208-H210 VanDerWaalsContact C-N 3.27Å; L208-H210 PolarHBondContact O-N 2.97Å
211	S	90.4	Very high	93.1	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.014	15%	0.149	C	C	.	.	S	Bend	trans	-66.4	141	174.2	175.8	0	0	0	0	110.1	T207 L208 Q209 L213 T214 Q215 E332	T207-S211 VanDerWaalsContact OG1-CB 3.28Å; T207-S211 WeakPolarHBondContact OG1-CB 3.43Å; T207-S211 PolarHBondContact OG1-OG 2.89Å; L208-S211 WeakPolarHBondContact O-CB 3.27Å; L208-S211 PolarHBondContact O-N 2.89Å; Q209-S211 PolarHBondContact O-N 2.89Å; S211-L213 PolarHBondContact O-N 3.33Å; S211-L213 PolarHBondContact OG-N 2.84Å; S211-T214 PolarHBondContact O-N 2.99Å; S211-Q215 WeakPolarHBondContact O-CB 3.49Å; S211-Q215 VanDerWaalsContact O-CG 3.29Å; S211-Q215 WeakPolarHBondContact O-CG 3.29Å; S211-Q215 PolarHBondContact O-N 2.78Å; S211-E332 WeakPolarHBondContact CB-OE2 3.13Å; S211-E332 PolarHBondContact OG-OE1 3.34Å; S211-E332 PolarHBondContact OG-OE2 3.47Å
212	R	91.8	Very high	93.1	Very high	133 Å²	133	31.6 Å²	31.6	50%	0.502	15%	0.154	S	C	.	.	H	α-helix	trans	-60.4	-36.5	174.7	-174.8	56.5	175.3	162.1	1.3	111.7	L216	R212-L216 HydrophobicContact CG-CD1 4.13Å; R212-L216 WeakPolarHBondContact O-CB 3.44Å; R212-L216 VanDerWaalsContact O-CG 3.24Å; R212-L216 WeakPolarHBondContact O-CG 3.49Å; R212-L216 PolarHBondContact O-N 2.95Å; R212-L216 VanDerWaalsContact O-N 3.11Å
213	L	93.1	Very high	93	Very high	10 Å²	10	37 Å²	37	5%	0.052	18%	0.179	C	C	.	.	H	α-helix	trans	-62.9	-52.9	177.1	176.8	60.7	0	0	0	111	S211 Q215 L216 L217 L317 L320 L321 T324	S211-L213 PolarHBondContact O-N 3.33Å; S211-L213 PolarHBondContact OG-N 2.84Å; L213-Q215 PolarHBondContact O-N 2.84Å; L213-L216 PolarHBondContact O-N 3.15Å; L213-L217 HydrophobicContact CD1-CD1 4.03Å; L213-L217 HydrophobicContact CD1-CG 4.29Å; L213-L217 HydrophobicContact CG-CD1 4.11Å; L213-L217 WeakPolarHBondContact O-CG 3.24Å; L213-L217 PolarHBondContact O-N 2.91Å; L213-L317 HydrophobicContact CD2-CD1 3.68Å; L213-L320 HydrophobicContact CD1-CB 3.98Å; L213-L320 HydrophobicContact CD2-CB 3.8Å; L213-L321 HydrophobicContact CB-CD2 3.96Å; L213-L321 HydrophobicContact CD2-CD2 3.65Å; L213-L321 HydrophobicContact CD2-CG 4.1Å; L213-L321 HydrophobicContact CG-CD2 4.47Å; L213-T324 HydrophobicContact CB-CG2 4.07Å; L213-T324 HydrophobicContact CD1-CG2 4.2Å
214	T	93.6	Very high	93	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-56.6	-48	177.7	-60.3	0	0	0	0	111.7	G205 T207 L208 S211 L216 L217 H218	G205-T214 WeakPolarHBondContact O-CG2 3.38Å; T207-T214 PolarHBondContact N-OG1 3.36Å; T207-T214 PolarHBondContact OG1-OG1 2.9Å; L208-T214 VanDerWaalsContact O-CB 3.24Å; L208-T214 WeakPolarHBondContact O-CB 3.47Å; L208-T214 PolarHBondContact O-OG1 3.24Å; S211-T214 PolarHBondContact O-N 2.99Å; T214-L216 VanDerWaalsContact C-N 3.31Å; T214-L216 PolarHBondContact O-N 3.38Å; T214-L217 PolarHBondContact O-N 2.63Å; T214-H218 WeakPolarHBondContact O-CB 3.35Å; T214-H218 PolarHBondContact O-N 2.84Å
215	Q	93	Very high	93	Very high	89 Å²	89	40.5 Å²	40.5	42%	0.416	20%	0.195	S	C	.	.	H	α-helix	trans	-59.4	-39.7	179.2	-73.2	177.3	-5.9	0	0	113.1	S211 L213 L219	S211-Q215 WeakPolarHBondContact O-CB 3.49Å; S211-Q215 VanDerWaalsContact O-CG 3.29Å; S211-Q215 WeakPolarHBondContact O-CG 3.29Å; S211-Q215 PolarHBondContact O-N 2.78Å; L213-Q215 PolarHBondContact O-N 2.84Å; Q215-L219 WeakPolarHBondContact O-CB 3.32Å; Q215-L219 PolarHBondContact O-N 3.43Å
216	L	94.1	Very high	93.1	Very high	70 Å²	70	42.7 Å²	42.7	37%	0.366	21%	0.207	S	C	.	.	H	α-helix	trans	-69.1	-42.9	178.4	-73	171.4	0	0	0	111.7	R212 L213 T214 L219 A220 T324	R212-L216 HydrophobicContact CG-CD1 4.13Å; R212-L216 WeakPolarHBondContact O-CB 3.44Å; R212-L216 VanDerWaalsContact O-CG 3.24Å; R212-L216 WeakPolarHBondContact O-CG 3.49Å; R212-L216 PolarHBondContact O-N 2.95Å; R212-L216 VanDerWaalsContact O-N 3.11Å; L213-L216 PolarHBondContact O-N 3.15Å; T214-L216 VanDerWaalsContact C-N 3.31Å; T214-L216 PolarHBondContact O-N 3.38Å; L216-L219 PolarHBondContact O-N 2.84Å; L216-A220 PolarHBondContact O-N 2.94Å; L216-T324 HydrophobicContact CD1-CG2 4.31Å
217	L	94.1	Very high	93.3	Very high	60 Å²	60	50.1 Å²	50.1	31%	0.314	24%	0.239	S	C	.	.	H	α-helix	trans	-65.5	-46.4	177.3	-68.2	173.4	0	0	0	111.5	P206 L213 T214 L219 A220 L221	P206-L217 HydrophobicContact CG-CD1 3.67Å; L213-L217 HydrophobicContact CD1-CD1 4.03Å; L213-L217 HydrophobicContact CD1-CG 4.29Å; L213-L217 HydrophobicContact CG-CD1 4.11Å; L213-L217 WeakPolarHBondContact O-CG 3.24Å; L213-L217 PolarHBondContact O-N 2.91Å; T214-L217 PolarHBondContact O-N 2.63Å; L217-L219 VanDerWaalsContact C-N 3.33Å; L217-L219 PolarHBondContact O-N 3.09Å; L217-A220 PolarHBondContact O-N 3.21Å; L217-L221 WeakPolarHBondContact O-CG 3.42Å; L217-L221 PolarHBondContact O-N 3.37Å
218	H	95.1	Very high	93.4	Very high	7 Å²	7	54.8 Å²	54.8	3%	0.032	26%	0.26	C	S	.	.	H	α-helix	trans	-61.9	-40.7	176.1	-74.7	-170.2	0	0	0	111.8	L203 G205 Q209 T214 R222 I309	L203-H218 HydrophobicContact CD1-CB 4.33Å; L203-H218 PolarHBondContact O-CE1 3.28Å; L203-H218 VanDerWaalsContact O-CE1 3.25Å; G205-H218 PolarHBondContact O-CE1 3.42Å; G205-H218 PolarHBondContact O-NE2 2.97Å; Q209-H218 PolarHBondContact OE1-CE1 3.38Å; Q209-H218 PolarHBondContact OE1-ND1 2.72Å; T214-H218 WeakPolarHBondContact O-CB 3.35Å; T214-H218 PolarHBondContact O-N 2.84Å; H218-R222 WeakPolarHBondContact O-CB 3.38Å; H218-R222 PolarHBondContact O-N 3.1Å; H218-I309 WeakPolarHBondContact CD2-CD1 3.41Å; H218-I309 VanDerWaalsContact NE2-CD1 3.33Å; H218-I309 WeakPolarHBondContact NE2-CD1 3.49Å
219	L	95.4	Very high	93.6	Very high	61 Å²	61	54.4 Å²	54.4	32%	0.319	26%	0.257	S	S	.	.	H	α-helix	trans	-60.5	-48.5	176.1	178.3	66.1	0	0	0	111.2	Q215 L216 L217 L221 R222 E223	Q215-L219 WeakPolarHBondContact O-CB 3.32Å; Q215-L219 PolarHBondContact O-N 3.43Å; L216-L219 PolarHBondContact O-N 2.84Å; L217-L219 VanDerWaalsContact C-N 3.33Å; L217-L219 PolarHBondContact O-N 3.09Å; L219-L221 PolarHBondContact O-N 2.93Å; L219-R222 PolarHBondContact O-N 3.25Å; L219-E223 HydrophobicContact CD1-CG 4.14Å; L219-E223 WeakPolarHBondContact CD1-OE1 3.19Å; L219-E223 WeakPolarHBondContact O-CG 3.39Å; L219-E223 PolarHBondContact O-N 3.34Å
220	A	95.8	Very high	93.7	Very high	35 Å²	35	56 Å²	56	29%	0.289	28%	0.276	S	S	.	.	H	α-helix	trans	-61.7	-45.3	-179.7	0	0	0	0	0	112.5	L216 L217 E224 L356	L216-A220 PolarHBondContact O-N 2.94Å; L217-A220 PolarHBondContact O-N 3.21Å; A220-E224 PolarHBondContact O-N 2.86Å; A220-L356 HydrophobicContact CB-CD1 4.02Å; A220-L356 HydrophobicContact CB-CD2 4.17Å
221	L	96	Very high	93.6	Very high	9 Å²	9	60.6 Å²	60.6	5%	0.047	30%	0.295	C	S	.	.	H	α-helix	trans	-64.1	-47.4	176.1	-71.4	166.5	0	0	0	111.2	L203 L217 L219 E223 E224 I225 I309 L356 A359 I363	L203-L221 HydrophobicContact CD1-CB 4.43Å; L217-L221 WeakPolarHBondContact O-CG 3.42Å; L217-L221 PolarHBondContact O-N 3.37Å; L219-L221 PolarHBondContact O-N 2.93Å; L221-E223 PolarHBondContact O-N 3.16Å; L221-E224 PolarHBondContact O-N 3.39Å; L221-I225 HydrophobicContact CB-CD1 4.34Å; L221-I225 WeakPolarHBondContact O-CB 3.36Å; L221-I225 VanDerWaalsContact O-CD1 3.29Å; L221-I225 WeakPolarHBondContact O-CD1 3.13Å; L221-I225 WeakPolarHBondContact O-CG1 3.28Å; L221-I225 PolarHBondContact O-N 2.95Å; L221-I309 HydrophobicContact CD1-CD1 3.35Å; L221-I309 HydrophobicContact CD1-CG1 3.85Å; L221-L356 HydrophobicContact CD2-CD1 3.65Å; L221-L356 HydrophobicContact CG-CD1 4Å; L221-A359 HydrophobicContact CD2-CB 3.99Å; L221-I363 HydrophobicContact CD2-CD1 4.18Å
222	R	95.4	Very high	93.4	Very high	31 Å²	31	65.3 Å²	65.3	12%	0.117	32%	0.32	C	S	.	.	H	α-helix	trans	-57.6	-47.8	179.8	170.2	174	61.6	-142.8	-4	111.9	H218 L219 E224 I225 L226 Y235 L285 D287	H218-R222 WeakPolarHBondContact O-CB 3.38Å; H218-R222 PolarHBondContact O-N 3.1Å; L219-R222 PolarHBondContact O-N 3.25Å; R222-E224 VanDerWaalsContact C-N 3.34Å; R222-E224 PolarHBondContact O-N 2.85Å; R222-I225 PolarHBondContact O-N 2.94Å; R222-L226 HydrophobicContact CG-CD1 3.55Å; R222-L226 HydrophobicContact CG-CG 4.08Å; R222-L226 VanDerWaalsContact O-CB 3.28Å; R222-L226 WeakPolarHBondContact O-CB 3.37Å; R222-L226 WeakPolarHBondContact O-CG 3.5Å; R222-L226 PolarHBondContact O-N 2.84Å; R222-Y235 PolarHBondContact NH1-OH 3.19Å; R222-L285 HydrophobicContact CB-CD2 3.97Å; R222-L285 HydrophobicContact CG-CD2 3.62Å; R222-D287 IonicContact CZ-OD2 2.62Å; R222-D287 IonicContact NH1-OD2 3.18Å; R222-D287 PolarHBondContact NH1-OD2 3.14Å
223	E	95.2	Very high	93.5	Very high	118 Å²	118	59.5 Å²	59.5	55%	0.551	30%	0.298	S	S	*	.	H	α-helix	trans	-61	-44.3	-178.5	-75.9	-178.6	171.9	0	0	111.6	L219 L221 K227	L219-E223 HydrophobicContact CD1-CG 4.14Å; L219-E223 WeakPolarHBondContact CD1-OE1 3.19Å; L219-E223 WeakPolarHBondContact O-CG 3.39Å; L219-E223 PolarHBondContact O-N 3.34Å; L221-E223 PolarHBondContact O-N 3.16Å; E223-K227 VanDerWaalsContact O-CB 3.25Å; E223-K227 WeakPolarHBondContact O-CB 3.42Å; E223-K227 PolarHBondContact O-N 3.02Å
224	E	95.3	Very high	93.5	Very high	82 Å²	82	62.4 Å²	62.4	38%	0.383	31%	0.311	S	S	.	.	H	α-helix	trans	-68.3	-41.1	179.8	-168.6	66.7	-171.4	0	0	111.9	A220 L221 R222 K227 H228 T360	A220-E224 PolarHBondContact O-N 2.86Å; L221-E224 PolarHBondContact O-N 3.39Å; R222-E224 VanDerWaalsContact C-N 3.34Å; R222-E224 PolarHBondContact O-N 2.85Å; E224-K227 PolarHBondContact O-N 3.39Å; E224-H228 PolarHBondContact O-N 3.35Å; E224-H228 VanDerWaalsContact O-N 3.12Å; E224-T360 HydrophobicContact CB-CG2 3.9Å; E224-T360 HydrophobicContact CG-CG2 3.48Å; E224-T360 VanDerWaalsContact CG-CG2 3.48Å
225	I	95.3	Very high	93.5	Very high	1 Å²	1	65.8 Å²	65.8	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-65.3	-46.6	176.7	-64.4	161.2	0	0	0	110.7	L221 R222 K227 H228 F229 M233 T360 I363 L367	L221-I225 HydrophobicContact CB-CD1 4.34Å; L221-I225 WeakPolarHBondContact O-CB 3.36Å; L221-I225 VanDerWaalsContact O-CD1 3.29Å; L221-I225 WeakPolarHBondContact O-CD1 3.13Å; L221-I225 WeakPolarHBondContact O-CG1 3.28Å; L221-I225 PolarHBondContact O-N 2.95Å; R222-I225 PolarHBondContact O-N 2.94Å; I225-K227 VanDerWaalsContact C-N 3.27Å; I225-K227 PolarHBondContact O-N 3.41Å; I225-H228 PolarHBondContact O-N 2.89Å; I225-F229 HydrophobicContact CG2-CD2 3.82Å; I225-F229 HydrophobicContact CG2-CE2 4.02Å; I225-F229 WeakPolarHBondContact O-CD2 3.25Å; I225-F229 PolarHBondContact O-N 3.25Å; I225-F229 VanDerWaalsContact O-N 3.13Å; I225-M233 HydrophobicContact CG2-CE 3.57Å; I225-M233 HydrophobicContact CG2-SD 3.51Å; I225-M233 VanDerWaalsContact CG2-SD 3.51Å; I225-T360 HydrophobicContact CG1-CG2 3.91Å; I225-I363 HydrophobicContact CD1-CB 4.39Å; I225-I363 HydrophobicContact CD1-CD1 3.76Å; I225-I363 HydrophobicContact CD1-CG2 3.78Å; I225-I363 HydrophobicContact CG1-CG2 4.22Å; I225-L367 HydrophobicContact CG2-CD1 4.2Å
226	L	94.8	Very high	93.6	Very high	47 Å²	47	62.3 Å²	62.3	25%	0.246	31%	0.309	C	S	.	.	H	α-helix	trans	-63	-36.2	178.7	-72.9	176.5	0	0	0	111.7	R222 G230 M233 Y235	R222-L226 HydrophobicContact CG-CD1 3.55Å; R222-L226 HydrophobicContact CG-CG 4.08Å; R222-L226 VanDerWaalsContact O-CB 3.28Å; R222-L226 WeakPolarHBondContact O-CB 3.37Å; R222-L226 WeakPolarHBondContact O-CG 3.5Å; R222-L226 PolarHBondContact O-N 2.84Å; L226-G230 WeakPolarHBondContact O-CA 3.41Å; L226-G230 PolarHBondContact O-N 2.61Å; L226-M233 HydrophobicContact CD2-CB 4.4Å; L226-M233 HydrophobicContact CD2-CG 3.9Å; L226-M233 HydrophobicContact CD2-SD 4.41Å; L226-Y235 HydrophobicContact CD1-CG 4.49Å
227	K	94.6	Very high	93.4	Very high	160 Å²	160	66.2 Å²	66.2	70%	0.696	32%	0.323	S	S	*	.	H	α-helix	trans	-63.9	-39.1	175.2	-176.3	-178.3	175.8	-171	0	112.2	E223 E224 I225	E223-K227 VanDerWaalsContact O-CB 3.25Å; E223-K227 WeakPolarHBondContact O-CB 3.42Å; E223-K227 PolarHBondContact O-N 3.02Å; E224-K227 PolarHBondContact O-N 3.39Å; I225-K227 VanDerWaalsContact C-N 3.27Å; I225-K227 PolarHBondContact O-N 3.41Å
228	H	94.1	Very high	93.1	Very high	100 Å²	100	63.5 Å²	63.5	46%	0.463	31%	0.309	S	S	.	.	H	α-helix	trans	-68.8	-49	178.8	-171.4	83.9	0	0	0	112.6	E224 I225 I364 E368	E224-H228 PolarHBondContact O-N 3.35Å; E224-H228 VanDerWaalsContact O-N 3.12Å; I225-H228 PolarHBondContact O-N 2.89Å; H228-I364 HydrophobicContact CB-CD1 3.76Å; H228-I364 HydrophobicContact CB-CG1 4.34Å; H228-I364 VanDerWaalsContact CD2-CG2 3.48Å; H228-I364 WeakPolarHBondContact CD2-CG2 3.42Å; H228-I364 VanDerWaalsContact NE2-CG2 3.26Å; H228-I364 WeakPolarHBondContact NE2-CG2 3.44Å; H228-E368 IonicContact CD2-OE1 3.21Å; H228-E368 IonicContact CE1-OE1 2.63Å; H228-E368 IonicContact NE2-OE1 3.93Å; H228-E368 PolarHBondContact NE2-OE1 3.32Å
229	F	92.6	Very high	92.6	Very high	17 Å²	17	67.4 Å²	67.4	8%	0.075	33%	0.33	C	S	.	.	H	α-helix	trans	-85.5	-16.7	-175.2	-68.3	-72.6	0	0	0	114.2	I225 K231 N232 M233 L283 I364 L367 E368 I371	I225-F229 HydrophobicContact CG2-CD2 3.82Å; I225-F229 HydrophobicContact CG2-CE2 4.02Å; I225-F229 WeakPolarHBondContact O-CD2 3.25Å; I225-F229 PolarHBondContact O-N 3.25Å; I225-F229 VanDerWaalsContact O-N 3.13Å; F229-K231 PolarHBondContact O-N 2.96Å; F229-K231 VanDerWaalsContact O-N 3.14Å; F229-N232 WeakPolarHBondContact O-CB 3.32Å; F229-N232 PolarHBondContact O-N 2.91Å; F229-M233 HydrophobicContact CB-CB 3.56Å; F229-M233 HydrophobicContact CB-SD 4.24Å; F229-M233 HydrophobicContact CD2-SD 3.79Å; F229-M233 HydrophobicContact CG-CB 4.39Å; F229-M233 HydrophobicContact CG-SD 4.27Å; F229-L283 HydrophobicContact CD1-CD1 4.18Å; F229-L283 HydrophobicContact CD2-CD1 4.42Å; F229-L283 HydrophobicContact CE1-CD1 4.24Å; F229-L283 HydrophobicContact CE2-CD1 4.48Å; F229-L283 HydrophobicContact CG-CD1 4.28Å; F229-L283 HydrophobicContact CZ-CD1 4.4Å; F229-I364 HydrophobicContact CE2-CB 4.46Å; F229-I364 HydrophobicContact CE2-CG1 3.98Å; F229-I364 HydrophobicContact CZ-CB 4.44Å; F229-I364 HydrophobicContact CZ-CG1 4.42Å; F229-I364 HydrophobicContact CZ-CG2 4.13Å; F229-L367 HydrophobicContact CE1-CB 4.39Å; F229-L367 HydrophobicContact CE2-CB 3.95Å; F229-L367 HydrophobicContact CE2-CD1 3.82Å; F229-L367 HydrophobicContact CZ-CB 3.56Å; F229-L367 HydrophobicContact CZ-CD1 4.31Å; F229-E368 HydrophobicContact CE1-CG 4Å; F229-E368 HydrophobicContact CZ-CG 4.15Å; F229-I371 HydrophobicContact CD1-CD1 3.77Å; F229-I371 HydrophobicContact CE1-CD1 3.62Å
230	G	90.1	Very high	92.2	Very high	43 Å²	43	64.6 Å²	64.6	44%	0.443	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	51.3	-118.1	176.1	0	0	0	0	0	112.6	L226 N232	L226-G230 WeakPolarHBondContact O-CA 3.41Å; L226-G230 PolarHBondContact O-N 2.61Å; G230-N232 VanDerWaalsContact C-N 3.27Å; G230-N232 PolarHBondContact O-N 3.13Å
231	K	86.1	Confident	91.4	Very high	197 Å²	197	63.1 Å²	63.1	86%	0.857	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-72.7	-16.5	-176.9	-61.6	-178.8	-177.1	177.2	0	114.2	F229 M233	F229-K231 PolarHBondContact O-N 2.96Å; F229-K231 VanDerWaalsContact O-N 3.14Å; K231-M233 VanDerWaalsContact C-N 3.27Å
232	N	85.9	Confident	90.2	Very high	102 Å²	102	63.2 Å²	63.2	55%	0.545	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-81.7	-10.3	-177.2	-67.2	-23	0	0	0	112.8	F229 G230 L283	F229-N232 WeakPolarHBondContact O-CB 3.32Å; F229-N232 PolarHBondContact O-N 2.91Å; G230-N232 VanDerWaalsContact C-N 3.27Å; G230-N232 PolarHBondContact O-N 3.13Å; N232-L283 PolarHBondContact O-N 2.87Å
233	M	93.8	Very high	88.5	Confident	10 Å²	10	64.1 Å²	64.1	5%	0.049	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	133.4	178	-172.3	159.8	176.5	0	0	111.1	I201 I225 L226 F229 K231 L283 L285	I201-M233 HydrophobicContact CD1-CE 4Å; I225-M233 HydrophobicContact CG2-CE 3.57Å; I225-M233 HydrophobicContact CG2-SD 3.51Å; I225-M233 VanDerWaalsContact CG2-SD 3.51Å; L226-M233 HydrophobicContact CD2-CB 4.4Å; L226-M233 HydrophobicContact CD2-CG 3.9Å; L226-M233 HydrophobicContact CD2-SD 4.41Å; F229-M233 HydrophobicContact CB-CB 3.56Å; F229-M233 HydrophobicContact CB-SD 4.24Å; F229-M233 HydrophobicContact CD2-SD 3.79Å; F229-M233 HydrophobicContact CG-CB 4.39Å; F229-M233 HydrophobicContact CG-SD 4.27Å; K231-M233 VanDerWaalsContact C-N 3.27Å; M233-L283 CarbonylContact C-O 3.59Å; M233-L283 WeakPolarHBondContact CA-O 3.21Å; M233-L283 HydrophobicContact CB-CB 4.02Å; M233-L283 HydrophobicContact CG-CB 3.8Å; M233-L283 HydrophobicContact SD-CB 4.2Å; M233-L283 HydrophobicContact SD-CD1 4.23Å; M233-L285 HydrophobicContact CE-CB 3.63Å; M233-L285 HydrophobicContact CE-CD1 3.71Å; M233-L285 HydrophobicContact CE-CG 4.25Å
234	K	93.4	Very high	86.6	Confident	71 Å²	71	63 Å²	63	31%	0.309	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	156.8	175.3	-64.8	-179.3	-175.6	173.7	0	109.7	M277 H282 L283 L284 L285	K234-M277 HydrophobicContact CB-CE 4.07Å; K234-M277 HydrophobicContact CD-CE 4.08Å; K234-H282 HydrophobicContact CD-CB 4.47Å; K234-H282 VanDerWaalsContact CE-CD2 3.41Å; K234-H282 WeakPolarHBondContact CE-CD2 3.02Å; K234-H282 PolarHBondContact NZ-CD2 2.82Å; K234-H282 VanDerWaalsContact NZ-CD2 3.28Å; K234-L283 PolarHBondContact N-O 2.96Å; K234-L284 HydrophobicContact CB-CD1 3.8Å; K234-L284 WeakPolarHBondContact O-CA 3.42Å; K234-L285 PolarHBondContact O-N 2.93Å
235	Y	94.6	Very high	84.5	Confident	71 Å²	71	65.5 Å²	65.5	28%	0.278	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	134.6	176.6	169	-108.1	0	0	0	109.2	R222 L226 K237 L285 D287	R222-Y235 PolarHBondContact NH1-OH 3.19Å; L226-Y235 HydrophobicContact CD1-CG 4.49Å; Y235-K237 HydrophobicContact CE1-CG 4.04Å; Y235-K237 WeakPolarHBondContact OH-CE 3.06Å; Y235-K237 WeakPolarHBondContact OH-CG 3.41Å; Y235-L285 WeakPolarHBondContact CA-O 3.46Å; Y235-L285 HydrophobicContact CD2-CB 4.18Å; Y235-L285 HydrophobicContact CD2-CD2 3.78Å; Y235-L285 HydrophobicContact CD2-CG 4.45Å; Y235-L285 HydrophobicContact CE2-CD2 4.1Å; Y235-D287 HydrophobicContact CE2-CB 3.58Å; Y235-D287 WeakPolarHBondContact OH-CB 3.45Å; Y235-D287 PolarHBondContact OH-OD2 3.28Å; Y235-D287 VanDerWaalsContact OH-OD2 3.05Å
236	V	93.7	Very high	81.9	Confident	17 Å²	17	70.8 Å²	70.8	10%	0.103	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	137.6	176.3	69	0	0	0	0	109.8	L273 M277 L284 L285 V286 D287	V236-L273 HydrophobicContact CG2-CD2 4.43Å; V236-M277 HydrophobicContact CB-CE 4.1Å; V236-M277 HydrophobicContact CB-SD 4Å; V236-M277 HydrophobicContact CG1-SD 4.41Å; V236-M277 HydrophobicContact CG2-SD 3.97Å; V236-L284 HydrophobicContact CB-CD1 4.19Å; V236-L284 HydrophobicContact CG1-CD1 3.77Å; V236-L284 HydrophobicContact CG1-CD2 4.15Å; V236-L284 HydrophobicContact CG1-CG 4.11Å; V236-L285 PolarHBondContact N-O 3.34Å; V236-V286 HydrophobicContact CG1-CB 4.32Å; V236-V286 HydrophobicContact CG1-CG1 4.31Å; V236-V286 HydrophobicContact CG1-CG2 3.81Å; V236-V286 WeakPolarHBondContact O-CA 3.45Å; V236-D287 PolarHBondContact O-N 3Å
237	K	90.6	Very high	79.5	Confident	152 Å²	152	71.6 Å²	71.6	66%	0.661	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.5	133.8	164.1	-71.3	-171.5	175.6	-173	0	108.1	Y235 D287	Y235-K237 HydrophobicContact CE1-CG 4.04Å; Y235-K237 WeakPolarHBondContact OH-CE 3.06Å; Y235-K237 WeakPolarHBondContact OH-CG 3.41Å; K237-D287 WeakPolarHBondContact CA-O 3.41Å
238	S	88.4	Confident	77	Confident	3 Å²	3	71.3 Å²	71.3	2%	0.021	39%	0.394	C	S	.	.			trans	-143.6	143.8	-174.6	-155.1	0	0	0	0	108.3	E270 D287 S288	S238-E270 WeakPolarHBondContact CB-OE2 3.29Å; S238-E270 PolarHBondContact OG-OE2 3.25Å; S238-D287 PolarHBondContact N-O 3.12Å; S238-S288 WeakPolarHBondContact O-CA 3.45Å; S238-S288 WeakPolarHBondContact O-CB 3.47Å; S238-S288 PolarHBondContact O-OG 3.24Å
239	D	84.1	Confident	74.6	Confident	88 Å²	88	77.6 Å²	77.6	47%	0.471	41%	0.413	S	S	.	.			trans	-93.8	17.9	174.5	-68.1	-38.8	0	0	0	113.8	S242 E270 H290	D239-S242 WeakPolarHBondContact O-CB 3.33Å; D239-S242 PolarHBondContact O-OG 2.8Å; D239-E270 VanDerWaalsContact C-OE2 3.24Å; D239-E270 WeakPolarHBondContact CA-OE2 3.47Å; D239-E270 PolarHBondContact N-OE1 2.95Å; D239-E270 PolarHBondContact N-OE2 3.34Å; D239-H290 PolarHBondContact O-ND1 2.91Å; D239-H290 IonicContact OD1-CE1 2.65Å; D239-H290 IonicContact OD1-ND1 3.67Å
240	I	86.9	Confident	72.2	Confident	2 Å²	2	84.2 Å²	84.2	1%	0.01	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	145.9	172.6	54.6	163.5	0	0	0	112.5	E267 E270 V271 I274 V286 S288 I291 L300 L302	I240-E267 HydrophobicContact CG2-CG 4.47Å; I240-E270 HydrophobicContact CG2-CB 3.78Å; I240-E270 VanDerWaalsContact CG2-OE2 3.32Å; I240-E270 WeakPolarHBondContact CG2-OE2 3.27Å; I240-E270 PolarHBondContact N-OE2 3.04Å; I240-V271 HydrophobicContact CG2-CG2 4.37Å; I240-I274 HydrophobicContact CD1-CD1 3.93Å; I240-I274 HydrophobicContact CG2-CD1 4.24Å; I240-V286 HydrophobicContact CD1-CG1 3.88Å; I240-V286 HydrophobicContact CG1-CG1 4.36Å; I240-S288 PolarHBondContact O-OG 3.41Å; I240-I291 HydrophobicContact CD1-CD1 3.72Å; I240-I291 HydrophobicContact CG1-CD1 3.93Å; I240-L300 HydrophobicContact CB-CD1 4.18Å; I240-L300 HydrophobicContact CG2-CD1 4.34Å; I240-L302 HydrophobicContact CD1-CD1 3.73Å
241	G	78.4	Confident	69.7	Low	5 Å²	5	85 Å²	85	5%	0.052	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.1	4.9	-174.9	0	0	0	0	0	113.2	E267	G241-E267 WeakPolarHBondContact CA-OE1 3.25Å; G241-E267 PolarHBondContact N-OE1 3.28Å
242	S	70.8	Confident	67.6	Low	10 Å²	10	77.9 Å²	77.9	7%	0.07	43%	0.428	C	S	.	.			trans	-85.7	-19.4	179.5	67.6	0	0	0	0	113.5	D239 E267	D239-S242 WeakPolarHBondContact O-CB 3.33Å; D239-S242 PolarHBondContact O-OG 2.8Å; S242-E267 PolarHBondContact N-OE1 2.96Å
243	G	59.7	Low	65.7	Low	51 Å²	51	80.6 Å²	80.6	53%	0.526	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-22	-176.7	0	0	0	0	0	115	Q245 E267	G243-Q245 VanDerWaalsContact C-N 3.32Å; G243-Q245 PolarHBondContact O-N 3.42Å; G243-E267 WeakPolarHBondContact CA-OE2 3.39Å; G243-E267 PolarHBondContact N-OE1 3.39Å; G243-E267 PolarHBondContact N-OE2 2.93Å
244	Q	54.7	Low	63.5	Low	94 Å²	94	89.9 Å²	89.9	44%	0.439	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	9.2	-177.3	-125.1	-179.8	-40.6	0	0	114.5	S246 D295 D296 H299	Q244-S246 PolarHBondContact O-N 3.39Å; Q244-D295 PolarHBondContact OE1-O 3.08Å; Q244-D296 PolarHBondContact OE1-O 2.67Å; Q244-H299 PolarHBondContact OE1-CE1 3.27Å; Q244-H299 PolarHBondContact OE1-ND1 3.35Å
245	Q	52.5	Low	61.5	Low	134 Å²	134	93.6 Å²	93.6	63%	0.626	49%	0.488	S	S	*	.			trans	-66.5	76.4	170.8	-71.2	-174.9	20.8	0	0	110.6	G243 G247	G243-Q245 VanDerWaalsContact C-N 3.32Å; G243-Q245 PolarHBondContact O-N 3.42Å; Q245-G247 PolarHBondContact O-N 3.4Å
246	S	40.7	Very low	59.4	Low	113 Å²	113	99.9 Å²	99.9	79%	0.79	51%	0.511	S	S	*	.			trans	-57.5	123.1	177.8	-175.5	0	0	0	0	111.3	Q244 D248	Q244-S246 PolarHBondContact O-N 3.39Å; S246-D248 PolarHBondContact O-N 2.93Å
247	G	44.2	Very low	56.9	Low	63 Å²	63	102.1 Å²	102.1	65%	0.649	54%	0.538	S	S	*	.	S	Bend	trans	78.4	-40.4	131.3	0	0	0	0	0	120.4	Q245	Q245-G247 PolarHBondContact O-N 3.4Å
248	D	40.9	Very low	54.8	Low	155 Å²	155	103.1 Å²	103.1	83%	0.829	55%	0.549	S	S	*	.			trans	-123.4	25	-150.9	-140.8	18.5	0	0	0	117.7	S246	S246-D248 PolarHBondContact O-N 2.93Å
249	R	43.7	Very low	52.8	Low	232 Å²	232	113.2 Å²	113.2	88%	0.875	59%	0.587	S	S	*	*			trans	-120.9	67.7	163.6	-67.5	-169.1	-169.2	-177.6	7.5	111.8	G251	R249-G251 PolarHBondContact O-N 2.86Å
250	K	43.3	Very low	51	Low	156 Å²	156	115.2 Å²	115.2	68%	0.678	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-64.1	-9.9	168.4	-76.7	-179	179.2	173.9	0	113.9
251	G	36.9	Very low	49	Very low	58 Å²	58	126.2 Å²	126.2	60%	0.598	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-88.2	-4.5	-172.2	0	0	0	0	0	117.8	R249	R249-G251 PolarHBondContact O-N 2.86Å
252	A	43.1	Very low	47.7	Very low	49 Å²	49	129 Å²	129	41%	0.405	65%	0.654	S	S	.	*	G	3₁₀ helix	trans	-124.2	17.6	-177.4	0	0	0	0	0	113.8
253	R	45.5	Very low	46.9	Very low	158 Å²	158	134.1 Å²	134.1	60%	0.596	67%	0.672	S	S	*	*	S	Bend	trans	-74.5	-29.9	-173.5	-167	171.8	-70.6	159.1	-2.6	113.6
254	W	48	Very low	46.7	Very low	205 Å²	205	133.8 Å²	133.8	78%	0.777	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-83.1	-14.6	179.4	45.9	72.5	0	0	0	114.8
255	L	51.4	Low	47	Very low	150 Å²	150	135 Å²	135	79%	0.785	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-85.2	-6.3	176.9	-83.2	161.3	0	0	0	113.6
256	R	50.9	Low	48	Very low	202 Å²	202	131.8 Å²	131.8	76%	0.762	66%	0.661	S	S	*	*	G	3₁₀ helix	trans	-124	37.7	-176	-121.4	-170	-78.1	-131.3	2	113.2	L258	R256-L258 VanDerWaalsContact C-N 3.3Å; R256-L258 PolarHBondContact O-N 2.93Å
257	G	41.1	Very low	49.9	Very low	65 Å²	65	127.1 Å²	127.1	67%	0.67	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	34.8	-166.9	0	0	0	0	0	119.2
258	L	46.1	Very low	51.9	Low	172 Å²	172	128.9 Å²	128.9	90%	0.901	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.2	17.4	178	-77.2	178.3	0	0	0	117.1	R256	R256-L258 VanDerWaalsContact C-N 3.3Å; R256-L258 PolarHBondContact O-N 2.93Å
259	R	46.4	Very low	54.1	Low	216 Å²	216	126.6 Å²	126.6	82%	0.815	61%	0.606	S	S	*	*			trans	-158.5	37.2	-179.3	-125.5	174.6	-177.4	-156	-3.4	118.7	Y261	R259-Y261 PolarHBondContact O-N 3.29Å
260	D	45.8	Very low	56.3	Low	130 Å²	130	117.4 Å²	117.4	70%	0.695	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	17.2	-173.4	-103	-4	0	0	0	116.1
261	Y	45.3	Very low	58.6	Low	233 Å²	233	110.3 Å²	110.3	91%	0.914	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	0.2	179.6	-91.2	-86.2	0	0	0	116.1	R259	R259-Y261 PolarHBondContact O-N 3.29Å
262	D	50.8	Low	61.3	Low	63 Å²	63	112.9 Å²	112.9	34%	0.337	54%	0.539	S	S	.	.	S	Bend	trans	-129.2	-13.7	-164	-144.3	6.6	0	0	0	116.3	G264 Q265 D266	D262-G264 VanDerWaalsContact C-N 3.32Å; D262-G264 PolarHBondContact O-N 2.64Å; D262-G264 VanDerWaalsContact O-N 3.13Å; D262-Q265 WeakPolarHBondContact O-CA 3.3Å; D262-Q265 WeakPolarHBondContact O-CB 3.39Å; D262-Q265 PolarHBondContact O-N 3.33Å; D262-Q265 PolarHBondContact OD1-OE1 2.84Å; D262-D266 PolarHBondContact O-N 3.31Å
263	R	53.5	Low	63.7	Low	118 Å²	118	113.8 Å²	113.8	45%	0.445	54%	0.536	S	S	.	.	H	α-helix	trans	-64.9	-29.2	-165.5	-153.3	175.7	-174.6	-170.7	-1.9	115.2	E267	R263-E267 PolarHBondContact O-N 3.1Å
264	G	55.6	Low	66	Low	43 Å²	43	106.3 Å²	106.3	44%	0.443	51%	0.508	S	S	.	.	H	α-helix	trans	-82.5	-21.2	174.1	0	0	0	0	0	113.8	D262 N268	D262-G264 VanDerWaalsContact C-N 3.32Å; D262-G264 PolarHBondContact O-N 2.64Å; D262-G264 VanDerWaalsContact O-N 3.13Å; G264-N268 PolarHBondContact O-ND2 2.94Å
265	Q	61.6	Low	68.2	Low	120 Å²	120	99 Å²	99	56%	0.561	48%	0.483	S	S	*	.	H	α-helix	trans	-74.2	-39.6	168.4	-68.6	-168.5	5	0	0	109.8	D262 E267 N268 Q269	D262-Q265 WeakPolarHBondContact O-CA 3.3Å; D262-Q265 WeakPolarHBondContact O-CB 3.39Å; D262-Q265 PolarHBondContact O-N 3.33Å; D262-Q265 PolarHBondContact OD1-OE1 2.84Å; Q265-E267 PolarHBondContact O-N 2.91Å; Q265-N268 PolarHBondContact O-N 3.32Å; Q265-Q269 WeakPolarHBondContact O-CB 3.31Å; Q265-Q269 VanDerWaalsContact O-CG 3.22Å; Q265-Q269 WeakPolarHBondContact O-CG 3.28Å; Q265-Q269 PolarHBondContact O-N 3.14Å
266	D	73.2	Confident	70.2	Confident	66 Å²	66	97.9 Å²	97.9	35%	0.353	47%	0.469	S	S	.	.	H	α-helix	trans	-57.1	-49.9	176.4	-64.4	-30.6	0	0	0	111.9	D262 N268 Q269 E270	D262-D266 PolarHBondContact O-N 3.31Å; D266-N268 PolarHBondContact O-N 3.46Å; D266-Q269 PolarHBondContact O-N 2.95Å; D266-E270 WeakPolarHBondContact O-CG 2.95Å; D266-E270 PolarHBondContact O-N 3.45Å
267	E	81.4	Confident	72.1	Confident	15 Å²	15	90.1 Å²	90.1	7%	0.07	44%	0.442	C	S	.	.	H	α-helix	trans	-63.2	-38.8	-179.6	-173.7	167.6	-122.1	0	0	112.8	I240 G241 S242 G243 R263 Q265 E270 V271 H299 L300	I240-E267 HydrophobicContact CG2-CG 4.47Å; G241-E267 WeakPolarHBondContact CA-OE1 3.25Å; G241-E267 PolarHBondContact N-OE1 3.28Å; S242-E267 PolarHBondContact N-OE1 2.96Å; G243-E267 WeakPolarHBondContact CA-OE2 3.39Å; G243-E267 PolarHBondContact N-OE1 3.39Å; G243-E267 PolarHBondContact N-OE2 2.93Å; R263-E267 PolarHBondContact O-N 3.1Å; Q265-E267 PolarHBondContact O-N 2.91Å; E267-E270 PolarHBondContact O-N 3.02Å; E267-V271 WeakPolarHBondContact O-CG2 3.37Å; E267-V271 PolarHBondContact O-N 2.77Å; E267-H299 IonicContact OE2-NE2 3.49Å; E267-L300 HydrophobicContact CG-CD1 4.29Å; E267-L300 HydrophobicContact CG-CD2 4.17Å
268	N	85.3	Confident	74.6	Confident	101 Å²	101	87 Å²	87	54%	0.54	41%	0.41	S	S	.	.	H	α-helix	trans	-69.6	-37.6	175.7	-76	-49.7	0	0	0	112.5	G264 Q265 D266 E270 V271 E272	G264-N268 PolarHBondContact O-ND2 2.94Å; Q265-N268 PolarHBondContact O-N 3.32Å; D266-N268 PolarHBondContact O-N 3.46Å; N268-E270 VanDerWaalsContact C-N 3.31Å; N268-V271 PolarHBondContact O-N 3.4Å; N268-E272 PolarHBondContact O-N 3.03Å
269	Q	87.9	Confident	76.6	Confident	107 Å²	107	81.9 Å²	81.9	50%	0.5	39%	0.388	S	S	.	.	H	α-helix	trans	-64.1	-38.1	174.3	-73.5	173	33.8	0	0	111.5	Q265 D266 E272 L273	Q265-Q269 WeakPolarHBondContact O-CB 3.31Å; Q265-Q269 VanDerWaalsContact O-CG 3.22Å; Q265-Q269 WeakPolarHBondContact O-CG 3.28Å; Q265-Q269 PolarHBondContact O-N 3.14Å; D266-Q269 PolarHBondContact O-N 2.95Å; Q269-E272 PolarHBondContact O-N 3.3Å; Q269-L273 WeakPolarHBondContact O-CB 3.42Å; Q269-L273 PolarHBondContact O-N 2.7Å
270	E	90.1	Very high	78.6	Confident	38 Å²	38	78.9 Å²	78.9	18%	0.178	38%	0.381	C	S	.	.	H	α-helix	trans	-67.1	-41.1	174.6	-73.1	-166.6	169.6	0	0	112.7	S238 D239 I240 D266 E267 N268 E272 L273 I274	S238-E270 WeakPolarHBondContact CB-OE2 3.29Å; S238-E270 PolarHBondContact OG-OE2 3.25Å; D239-E270 VanDerWaalsContact C-OE2 3.24Å; D239-E270 WeakPolarHBondContact CA-OE2 3.47Å; D239-E270 PolarHBondContact N-OE1 2.95Å; D239-E270 PolarHBondContact N-OE2 3.34Å; I240-E270 HydrophobicContact CG2-CB 3.78Å; I240-E270 VanDerWaalsContact CG2-OE2 3.32Å; I240-E270 WeakPolarHBondContact CG2-OE2 3.27Å; I240-E270 PolarHBondContact N-OE2 3.04Å; D266-E270 WeakPolarHBondContact O-CG 2.95Å; D266-E270 PolarHBondContact O-N 3.45Å; E267-E270 PolarHBondContact O-N 3.02Å; N268-E270 VanDerWaalsContact C-N 3.31Å; E270-E272 VanDerWaalsContact C-N 3.3Å; E270-E272 PolarHBondContact O-N 2.84Å; E270-L273 WeakPolarHBondContact O-CB 3.31Å; E270-L273 PolarHBondContact O-N 3.06Å; E270-I274 WeakPolarHBondContact O-CG1 3.45Å; E270-I274 PolarHBondContact O-N 2.89Å
271	V	91.6	Very high	80.8	Confident	8 Å²	8	74 Å²	74	5%	0.048	36%	0.355	C	S	.	.	H	α-helix	trans	-58.3	-45.2	171.9	168.3	0	0	0	0	110.7	I240 E267 N268 L273 I274 M275 L300 P301 L302	I240-V271 HydrophobicContact CG2-CG2 4.37Å; E267-V271 WeakPolarHBondContact O-CG2 3.37Å; E267-V271 PolarHBondContact O-N 2.77Å; N268-V271 PolarHBondContact O-N 3.4Å; V271-L273 VanDerWaalsContact C-N 3.33Å; V271-L273 PolarHBondContact O-N 3.25Å; V271-I274 PolarHBondContact O-N 3.37Å; V271-M275 HydrophobicContact CG1-CE 4.05Å; V271-M275 HydrophobicContact CG1-SD 4.43Å; V271-M275 WeakPolarHBondContact O-CG 3.26Å; V271-M275 PolarHBondContact O-N 3.37Å; V271-L300 HydrophobicContact CG2-CB 4.41Å; V271-L300 HydrophobicContact CG2-CD1 4.04Å; V271-L300 HydrophobicContact CG2-CD2 4.07Å; V271-L300 HydrophobicContact CG2-CG 4.41Å; V271-P301 HydrophobicContact CG1-CG 3.91Å; V271-L302 HydrophobicContact CB-CD2 4.45Å; V271-L302 HydrophobicContact CG1-CD2 3.97Å; V271-L302 HydrophobicContact CG2-CD1 4.26Å; V271-L302 HydrophobicContact CG2-CD2 4.31Å; V271-L302 HydrophobicContact CG2-CG 4.29Å
272	E	92.4	Very high	83	Confident	112 Å²	112	65.1 Å²	65.1	52%	0.523	32%	0.321	S	S	.	.	H	α-helix	trans	-63.6	-39.1	177.2	-160.3	-163.9	145.3	0	0	111.7	N268 Q269 E270 M275 R276	N268-E272 PolarHBondContact O-N 3.03Å; Q269-E272 PolarHBondContact O-N 3.3Å; E270-E272 VanDerWaalsContact C-N 3.3Å; E270-E272 PolarHBondContact O-N 2.84Å; E272-M275 PolarHBondContact O-N 3.02Å; E272-R276 VanDerWaalsContact CD-NH2 3.26Å; E272-R276 WeakPolarHBondContact O-CB 3.33Å; E272-R276 PolarHBondContact O-N 2.66Å; E272-R276 IonicContact OE1-CZ 2.64Å; E272-R276 IonicContact OE1-NH2 3.97Å; E272-R276 PolarHBondContact OE1-NH2 3.34Å; E272-R276 IonicContact OE2-NH2 2.72Å
273	L	92.8	Very high	85.1	Confident	67 Å²	67	62.1 Å²	62.1	35%	0.351	31%	0.306	S	S	.	.	H	α-helix	trans	-59.9	-46.6	173.4	177.4	62.9	0	0	0	111.4	V236 Q269 E270 V271 R276 M277	V236-L273 HydrophobicContact CG2-CD2 4.43Å; Q269-L273 WeakPolarHBondContact O-CB 3.42Å; Q269-L273 PolarHBondContact O-N 2.7Å; E270-L273 WeakPolarHBondContact O-CB 3.31Å; E270-L273 PolarHBondContact O-N 3.06Å; V271-L273 VanDerWaalsContact C-N 3.33Å; V271-L273 PolarHBondContact O-N 3.25Å; L273-R276 PolarHBondContact O-N 3.12Å; L273-M277 HydrophobicContact CD1-CG 4.2Å; L273-M277 HydrophobicContact CD1-SD 4.27Å; L273-M277 HydrophobicContact CG-CG 4.49Å; L273-M277 HydrophobicContact CG-SD 4.17Å; L273-M277 VanDerWaalsContact O-CG 3.3Å; L273-M277 WeakPolarHBondContact O-CG 3.44Å; L273-M277 PolarHBondContact O-N 2.87Å
274	I	94.4	Very high	87.1	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-60.6	-47.1	177.1	-69.5	164.4	0	0	0	110.7	P196 P200 I240 E270 V271 R276 M277 T278 L284 V286 L302	P196-I274 HydrophobicContact CG-CG2 4.28Å; P200-I274 HydrophobicContact CB-CG2 4.09Å; P200-I274 HydrophobicContact CG-CG2 4.18Å; I240-I274 HydrophobicContact CD1-CD1 3.93Å; I240-I274 HydrophobicContact CG2-CD1 4.24Å; E270-I274 WeakPolarHBondContact O-CG1 3.45Å; E270-I274 PolarHBondContact O-N 2.89Å; V271-I274 PolarHBondContact O-N 3.37Å; I274-R276 VanDerWaalsContact C-N 3.29Å; I274-R276 PolarHBondContact O-N 3.37Å; I274-M277 PolarHBondContact O-N 2.8Å; I274-T278 VanDerWaalsContact O-CG2 3.3Å; I274-T278 WeakPolarHBondContact O-CG2 3.36Å; I274-T278 PolarHBondContact O-N 2.88Å; I274-T278 VanDerWaalsContact O-N 3.13Å; I274-T278 PolarHBondContact O-OG1 2.85Å; I274-L284 HydrophobicContact CB-CD2 4.25Å; I274-L284 HydrophobicContact CG1-CD2 4.27Å; I274-L284 HydrophobicContact CG2-CD2 3.73Å; I274-V286 HydrophobicContact CD1-CG1 4.34Å; I274-V286 HydrophobicContact CD1-CG2 4.24Å; I274-V286 HydrophobicContact CG1-CG2 4.37Å; I274-L302 HydrophobicContact CB-CD2 4.14Å; I274-L302 HydrophobicContact CD1-CD1 4.1Å; I274-L302 HydrophobicContact CD1-CD2 4.28Å; I274-L302 HydrophobicContact CG2-CD2 3.76Å
275	M	94.1	Very high	89.1	Confident	52 Å²	52	54.8 Å²	54.8	26%	0.256	27%	0.265	S	S	.	.	H	α-helix	trans	-59.4	-39.5	175.9	-73.2	-175.1	175.3	0	0	112	P196 V271 E272 T278 S279 P301	P196-M275 HydrophobicContact CG-CG 3.89Å; V271-M275 HydrophobicContact CG1-CE 4.05Å; V271-M275 HydrophobicContact CG1-SD 4.43Å; V271-M275 WeakPolarHBondContact O-CG 3.26Å; V271-M275 PolarHBondContact O-N 3.37Å; E272-M275 PolarHBondContact O-N 3.02Å; M275-T278 WeakPolarHBondContact CA-OG1 3.49Å; M275-T278 PolarHBondContact O-OG1 3.13Å; M275-S279 PolarHBondContact O-N 2.96Å; M275-P301 HydrophobicContact CE-CB 3.9Å; M275-P301 HydrophobicContact CE-CG 3.74Å; M275-P301 VanDerWaalsContact CE-O 3.27Å; M275-P301 WeakPolarHBondContact CE-O 3.39Å
276	R	93.1	Very high	90.7	Very high	126 Å²	126	49.1 Å²	49.1	48%	0.475	24%	0.239	S	C	.	.	H	α-helix	trans	-68.7	-41.1	177.6	-165.4	-176.7	-54.8	110.9	0.9	112.3	E272 L273 I274 T278 S279	E272-R276 VanDerWaalsContact CD-NH2 3.26Å; E272-R276 WeakPolarHBondContact O-CB 3.33Å; E272-R276 PolarHBondContact O-N 2.66Å; E272-R276 IonicContact OE1-CZ 2.64Å; E272-R276 IonicContact OE1-NH2 3.97Å; E272-R276 PolarHBondContact OE1-NH2 3.34Å; E272-R276 IonicContact OE2-NH2 2.72Å; L273-R276 PolarHBondContact O-N 3.12Å; I274-R276 VanDerWaalsContact C-N 3.29Å; I274-R276 PolarHBondContact O-N 3.37Å; R276-T278 VanDerWaalsContact C-N 3.28Å; R276-T278 PolarHBondContact O-N 2.87Å; R276-S279 WeakPolarHBondContact O-CB 3.26Å; R276-S279 PolarHBondContact O-N 3.09Å; R276-S279 PolarHBondContact O-OG 2.93Å
277	M	92.1	Very high	91.6	Very high	40 Å²	40	48 Å²	48	20%	0.197	23%	0.232	C	C	.	.	H	α-helix	trans	-65.6	-32.3	180	-73.8	-176.5	76.2	0	0	112.9	K234 V236 L273 I274 L284	K234-M277 HydrophobicContact CB-CE 4.07Å; K234-M277 HydrophobicContact CD-CE 4.08Å; V236-M277 HydrophobicContact CB-CE 4.1Å; V236-M277 HydrophobicContact CB-SD 4Å; V236-M277 HydrophobicContact CG1-SD 4.41Å; V236-M277 HydrophobicContact CG2-SD 3.97Å; L273-M277 HydrophobicContact CD1-CG 4.2Å; L273-M277 HydrophobicContact CD1-SD 4.27Å; L273-M277 HydrophobicContact CG-CG 4.49Å; L273-M277 HydrophobicContact CG-SD 4.17Å; L273-M277 VanDerWaalsContact O-CG 3.3Å; L273-M277 WeakPolarHBondContact O-CG 3.44Å; L273-M277 PolarHBondContact O-N 2.87Å; I274-M277 PolarHBondContact O-N 2.8Å; M277-L284 HydrophobicContact CB-CD1 4.42Å; M277-L284 HydrophobicContact CB-CD2 4.17Å; M277-L284 HydrophobicContact CE-CD1 3.66Å; M277-L284 HydrophobicContact SD-CD1 4.19Å
278	T	92.6	Very high	92	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-87	-8.4	-179.5	54.5	0	0	0	0	113.6	P196 S198 I274 M275 R276 K280 L281 L284	P196-T278 HydrophobicContact CB-CG2 4.33Å; P196-T278 WeakPolarHBondContact CB-OG1 3.46Å; S198-T278 VanDerWaalsContact O-CG2 3.25Å; S198-T278 WeakPolarHBondContact O-CG2 3.3Å; S198-T278 WeakPolarHBondContact OG-CB 3.32Å; S198-T278 VanDerWaalsContact OG-CG2 3.28Å; S198-T278 WeakPolarHBondContact OG-CG2 3.42Å; I274-T278 VanDerWaalsContact O-CG2 3.3Å; I274-T278 WeakPolarHBondContact O-CG2 3.36Å; I274-T278 PolarHBondContact O-N 2.88Å; I274-T278 VanDerWaalsContact O-N 3.13Å; I274-T278 PolarHBondContact O-OG1 2.85Å; M275-T278 WeakPolarHBondContact CA-OG1 3.49Å; M275-T278 PolarHBondContact O-OG1 3.13Å; R276-T278 VanDerWaalsContact C-N 3.28Å; R276-T278 PolarHBondContact O-N 2.87Å; T278-K280 PolarHBondContact O-N 2.74Å; T278-L281 PolarHBondContact O-N 2.86Å; T278-L284 HydrophobicContact CG2-CB 3.9Å; T278-L284 HydrophobicContact CG2-CD2 3.77Å
279	S	88.6	Confident	92.1	Very high	63 Å²	63	45.2 Å²	45.2	44%	0.441	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-30.1	-179.3	61.5	0	0	0	0	115.2	M275 R276	M275-S279 PolarHBondContact O-N 2.96Å; R276-S279 WeakPolarHBondContact O-CB 3.26Å; R276-S279 PolarHBondContact O-N 3.09Å; R276-S279 PolarHBondContact O-OG 2.93Å
280	K	88.9	Confident	92.1	Very high	154 Å²	154	42.3 Å²	42.3	67%	0.67	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.7	16.5	178.9	-67.4	-173.3	178.7	-176.1	0	113.9	T278 H282	T278-K280 PolarHBondContact O-N 2.74Å; K280-H282 WeakPolarHBondContact CB-NE2 3.48Å; K280-H282 PolarHBondContact O-N 3.42Å
281	L	91.4	Very high	92.1	Very high	27 Å²	27	40.5 Å²	40.5	14%	0.141	20%	0.199	C	C	.	.			trans	61.6	24.7	179.3	-50.2	177.3	0	0	0	114.4	V97 T278	V97-L281 HydrophobicContact CB-CD2 4.46Å; V97-L281 HydrophobicContact CG2-CD1 4.03Å; V97-L281 HydrophobicContact CG2-CD2 4.08Å; T278-L281 PolarHBondContact O-N 2.86Å
282	H	90.9	Very high	92	Very high	46 Å²	46	42.6 Å²	42.6	21%	0.213	21%	0.208	C	C	.	.			trans	-73.3	149.9	171	-60.1	-62.3	0	0	0	110.7	S198 K234 K280	S198-H282 WeakPolarHBondContact CB-O 3.34Å; S198-H282 PolarHBondContact OG-O 3.13Å; K234-H282 HydrophobicContact CD-CB 4.47Å; K234-H282 VanDerWaalsContact CE-CD2 3.41Å; K234-H282 WeakPolarHBondContact CE-CD2 3.02Å; K234-H282 PolarHBondContact NZ-CD2 2.82Å; K234-H282 VanDerWaalsContact NZ-CD2 3.28Å; K280-H282 WeakPolarHBondContact CB-NE2 3.48Å; K280-H282 PolarHBondContact O-N 3.42Å
283	L	95.3	Very high	91.8	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	143.7	165.3	-62.8	-174.5	0	0	0	109.5	I201 F229 N232 M233 K234 L367 Y370 I371 L374	I201-L283 HydrophobicContact CD1-CB 4.22Å; I201-L283 HydrophobicContact CD1-CD2 4.43Å; F229-L283 HydrophobicContact CD1-CD1 4.18Å; F229-L283 HydrophobicContact CD2-CD1 4.42Å; F229-L283 HydrophobicContact CE1-CD1 4.24Å; F229-L283 HydrophobicContact CE2-CD1 4.48Å; F229-L283 HydrophobicContact CG-CD1 4.28Å; F229-L283 HydrophobicContact CZ-CD1 4.4Å; N232-L283 PolarHBondContact O-N 2.87Å; M233-L283 CarbonylContact C-O 3.59Å; M233-L283 WeakPolarHBondContact CA-O 3.21Å; M233-L283 HydrophobicContact CB-CB 4.02Å; M233-L283 HydrophobicContact CG-CB 3.8Å; M233-L283 HydrophobicContact SD-CB 4.2Å; M233-L283 HydrophobicContact SD-CD1 4.23Å; K234-L283 PolarHBondContact N-O 2.96Å; L283-L367 HydrophobicContact CD1-CB 4.04Å; L283-L367 HydrophobicContact CD1-CD1 4.24Å; L283-L367 HydrophobicContact CD1-CD2 4.37Å; L283-L367 HydrophobicContact CD1-CG 4.45Å; L283-Y370 HydrophobicContact CD2-CD1 3.73Å; L283-Y370 HydrophobicContact CD2-CE1 4.04Å; L283-I371 HydrophobicContact CD1-CD1 3.66Å; L283-I371 HydrophobicContact CD1-CG1 3.91Å; L283-I371 HydrophobicContact CD2-CG1 3.92Å; L283-I371 HydrophobicContact CG-CD1 4.04Å; L283-I371 HydrophobicContact CG-CG1 3.91Å; L283-L374 HydrophobicContact CD2-CD1 4.26Å
284	L	96.5	Very high	91.8	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.01	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	115.3	177.9	-178.4	66.8	0	0	0	109.6	I201 K234 V236 I274 M277 T278 V286	I201-L284 PolarHBondContact N-O 3.11Å; K234-L284 HydrophobicContact CB-CD1 3.8Å; K234-L284 WeakPolarHBondContact O-CA 3.42Å; V236-L284 HydrophobicContact CB-CD1 4.19Å; V236-L284 HydrophobicContact CG1-CD1 3.77Å; V236-L284 HydrophobicContact CG1-CD2 4.15Å; V236-L284 HydrophobicContact CG1-CG 4.11Å; I274-L284 HydrophobicContact CB-CD2 4.25Å; I274-L284 HydrophobicContact CG1-CD2 4.27Å; I274-L284 HydrophobicContact CG2-CD2 3.73Å; M277-L284 HydrophobicContact CB-CD1 4.42Å; M277-L284 HydrophobicContact CB-CD2 4.17Å; M277-L284 HydrophobicContact CE-CD1 3.66Å; M277-L284 HydrophobicContact SD-CD1 4.19Å; T278-L284 HydrophobicContact CG2-CB 3.9Å; T278-L284 HydrophobicContact CG2-CD2 3.77Å; L284-V286 HydrophobicContact CD2-CG2 3.97Å; L284-V286 HydrophobicContact CG-CG2 3.98Å
285	L	96.8	Very high	91.5	Very high	4 Å²	4	38.5 Å²	38.5	2%	0.021	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	123.6	166.8	-162	91.9	0	0	0	109.1	I201 L203 R222 M233 K234 Y235 V236	I201-L285 HydrophobicContact CB-CD1 4.16Å; I201-L285 HydrophobicContact CG2-CD1 3.8Å; I201-L285 WeakPolarHBondContact O-CA 3.46Å; L203-L285 HydrophobicContact CG-CD1 4.31Å; R222-L285 HydrophobicContact CB-CD2 3.97Å; R222-L285 HydrophobicContact CG-CD2 3.62Å; M233-L285 HydrophobicContact CE-CB 3.63Å; M233-L285 HydrophobicContact CE-CD1 3.71Å; M233-L285 HydrophobicContact CE-CG 4.25Å; K234-L285 PolarHBondContact O-N 2.93Å; Y235-L285 WeakPolarHBondContact CA-O 3.46Å; Y235-L285 HydrophobicContact CD2-CB 4.18Å; Y235-L285 HydrophobicContact CD2-CD2 3.78Å; Y235-L285 HydrophobicContact CD2-CG 4.45Å; Y235-L285 HydrophobicContact CE2-CD2 4.1Å; V236-L285 PolarHBondContact N-O 3.34Å
286	V	95.6	Very high	91.2	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.012	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	118.9	176.3	-176.1	0	0	0	0	108.6	P200 I201 V202 V236 I240 I274 L284	P200-V286 HydrophobicContact CB-CG2 3.63Å; I201-V286 PolarHBondContact O-N 2.81Å; V202-V286 HydrophobicContact CG2-CB 4.31Å; V236-V286 HydrophobicContact CG1-CB 4.32Å; V236-V286 HydrophobicContact CG1-CG1 4.31Å; V236-V286 HydrophobicContact CG1-CG2 3.81Å; V236-V286 WeakPolarHBondContact O-CA 3.45Å; I240-V286 HydrophobicContact CD1-CG1 3.88Å; I240-V286 HydrophobicContact CG1-CG1 4.36Å; I274-V286 HydrophobicContact CD1-CG1 4.34Å; I274-V286 HydrophobicContact CD1-CG2 4.24Å; I274-V286 HydrophobicContact CG1-CG2 4.37Å; L284-V286 HydrophobicContact CD2-CG2 3.97Å; L284-V286 HydrophobicContact CG-CG2 3.98Å
287	D	92.4	Very high	91.1	Very high	42 Å²	42	32 Å²	32	23%	0.225	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	109.2	171.2	-177.6	11.1	0	0	0	108.2	R222 Y235 V236 K237 S238	R222-D287 IonicContact CZ-OD2 2.62Å; R222-D287 IonicContact NH1-OD2 3.18Å; R222-D287 PolarHBondContact NH1-OD2 3.14Å; Y235-D287 HydrophobicContact CE2-CB 3.58Å; Y235-D287 WeakPolarHBondContact OH-CB 3.45Å; Y235-D287 PolarHBondContact OH-OD2 3.28Å; Y235-D287 VanDerWaalsContact OH-OD2 3.05Å; V236-D287 PolarHBondContact O-N 3Å; K237-D287 WeakPolarHBondContact CA-O 3.41Å; S238-D287 PolarHBondContact N-O 3.12Å
288	S	90.3	Very high	90.9	Very high	4 Å²	4	35.7 Å²	35.7	3%	0.028	18%	0.184	C	C	.	.			trans	-121.8	128.5	172.9	170.6	0	0	0	0	110.1	S238 I240 H290	S238-S288 WeakPolarHBondContact O-CA 3.45Å; S238-S288 WeakPolarHBondContact O-CB 3.47Å; S238-S288 PolarHBondContact O-OG 3.24Å; I240-S288 PolarHBondContact O-OG 3.41Å; S288-H290 PolarHBondContact O-N 3.28Å; S288-H290 PolarHBondContact OG-N 3.35Å
289	P	87.1	Confident	90.6	Very high	53 Å²	53	40 Å²	40	34%	0.344	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-10.7	177.1	31.4	-34.5	0	0	0	112.9
290	H	87.5	Confident	90.7	Very high	46 Å²	46	37.2 Å²	37.2	21%	0.213	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-10.3	-174.1	-54.3	105.5	0	0	0	113.7	D239 S288 H292	D239-H290 PolarHBondContact O-ND1 2.91Å; D239-H290 IonicContact OD1-CE1 2.65Å; D239-H290 IonicContact OD1-ND1 3.67Å; S288-H290 PolarHBondContact O-N 3.28Å; S288-H290 PolarHBondContact OG-N 3.35Å; H290-H292 PolarHBondContact O-N 2.95Å
291	I	90.6	Very high	90.8	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	17%	0.165	C	C	.	.			trans	-92	96.9	-179.3	-51.5	175.3	0	0	0	110	V202 L204 Q209 I240 V297 F306	V202-I291 HydrophobicContact CG1-CD1 4.13Å; V202-I291 HydrophobicContact CG1-CG2 4.25Å; V202-I291 HydrophobicContact CG2-CD1 4.29Å; L204-I291 HydrophobicContact CD2-CG2 3.8Å; L204-I291 WeakPolarHBondContact CD2-O 3.25Å; Q209-I291 WeakPolarHBondContact CG-O 3.47Å; Q209-I291 PolarHBondContact NE2-O 3.14Å; I240-I291 HydrophobicContact CD1-CD1 3.72Å; I240-I291 HydrophobicContact CG1-CD1 3.93Å; I291-V297 HydrophobicContact CD1-CG1 3.67Å; I291-V297 HydrophobicContact CG1-CG1 3.72Å; I291-V297 HydrophobicContact CG2-CG1 4.37Å; I291-F306 HydrophobicContact CG2-CE1 4.35Å
292	H	88.3	Confident	90.8	Very high	52 Å²	52	30.5 Å²	30.5	24%	0.241	16%	0.158	C	C	.	.	S	Bend	trans	-92.5	-35	176.1	-64.6	-65	0	0	0	112.1	H290 D296	H290-H292 PolarHBondContact O-N 2.95Å; H292-D296 WeakPolarHBondContact CA-OD2 2.98Å; H292-D296 PolarHBondContact N-OD2 3.08Å
293	T	89.6	Confident	90.9	Very high	27 Å²	27	29.1 Å²	29.1	17%	0.166	15%	0.153	C	C	.	.	S	Bend	trans	-134	159.3	-178	65.1	0	0	0	0	110.3	D295 D296 M342	T293-D295 PolarHBondContact O-N 3.4Å; T293-D295 VanDerWaalsContact O-N 3.15Å; T293-D296 PolarHBondContact N-OD2 2.65Å; T293-D296 PolarHBondContact O-N 3.33Å; T293-D296 PolarHBondContact OG1-OD2 3.31Å; T293-M342 HydrophobicContact CG2-CE 3.91Å; T293-M342 HydrophobicContact CG2-SD 4.43Å
294	P	91.3	Very high	90.9	Very high	7 Å²	7	29.5 Å²	29.5	5%	0.045	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-57.9	-24.4	173.5	-26.8	37	0	0	0	114	L204 D296 Q298 F306 R346 F347	L204-P294 HydrophobicContact CD1-CG 3.99Å; P294-D296 VanDerWaalsContact C-N 3.3Å; P294-D296 PolarHBondContact O-N 2.99Å; P294-Q298 PolarHBondContact O-N 3.3Å; P294-F306 HydrophobicContact CB-CD2 4.05Å; P294-F306 HydrophobicContact CB-CE2 3.7Å; P294-F306 HydrophobicContact CB-CZ 3.97Å; P294-F306 HydrophobicContact CG-CD2 4.17Å; P294-F306 HydrophobicContact CG-CE2 4.29Å; P294-F306 HydrophobicContact CG-CG 4.35Å; P294-R346 HydrophobicContact CG-CB 4.45Å; P294-F347 HydrophobicContact CG-CD1 4.13Å; P294-F347 HydrophobicContact CG-CE1 3.54Å; P294-F347 HydrophobicContact CG-CZ 4.2Å
295	D	89.1	Confident	90.9	Very high	60 Å²	60	29.4 Å²	29.4	32%	0.321	16%	0.156	S	C	.	.	G	3₁₀ helix	trans	-67	-30.7	-179.1	-65.3	-35.3	0	0	0	112.3	Q244 T293 V297 Q298 R346	Q244-D295 PolarHBondContact OE1-O 3.08Å; T293-D295 PolarHBondContact O-N 3.4Å; T293-D295 VanDerWaalsContact O-N 3.15Å; D295-V297 PolarHBondContact O-N 3.36Å; D295-V297 VanDerWaalsContact O-N 3.08Å; D295-Q298 WeakPolarHBondContact O-CB 3.34Å; D295-Q298 PolarHBondContact O-N 3.25Å; D295-Q298 VanDerWaalsContact O-N 3.16Å; D295-Q298 PolarHBondContact OD1-OE1 3.14Å; D295-R346 IonicContact OD1-CZ 3.47Å; D295-R346 IonicContact OD1-NH1 3.48Å; D295-R346 PolarHBondContact OD1-NH1 2.93Å; D295-R346 IonicContact OD1-NH2 3.19Å; D295-R346 PolarHBondContact OD1-NH2 3.46Å
296	D	88	Confident	90.9	Very high	37 Å²	37	29.9 Å²	29.9	20%	0.198	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-62	-20.6	-177.1	-62	-40	0	0	0	113.4	Q244 H292 T293 P294 H299	Q244-D296 PolarHBondContact OE1-O 2.67Å; H292-D296 WeakPolarHBondContact CA-OD2 2.98Å; H292-D296 PolarHBondContact N-OD2 3.08Å; T293-D296 PolarHBondContact N-OD2 2.65Å; T293-D296 PolarHBondContact O-N 3.33Å; T293-D296 PolarHBondContact OG1-OD2 3.31Å; P294-D296 VanDerWaalsContact C-N 3.3Å; P294-D296 PolarHBondContact O-N 2.99Å; D296-H299 PolarHBondContact O-CE1 2.76Å; D296-H299 PolarHBondContact O-ND1 3.32Å
297	V	89.9	Confident	90.9	Very high	3 Å²	3	29.8 Å²	29.8	2%	0.018	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-125	9.3	-179.7	-62.5	0	0	0	0	112.7	I291 D295 H299 L300 P304 F306	I291-V297 HydrophobicContact CD1-CG1 3.67Å; I291-V297 HydrophobicContact CG1-CG1 3.72Å; I291-V297 HydrophobicContact CG2-CG1 4.37Å; D295-V297 PolarHBondContact O-N 3.36Å; D295-V297 VanDerWaalsContact O-N 3.08Å; V297-H299 PolarHBondContact O-N 3.34Å; V297-L300 HydrophobicContact CB-CD1 4.18Å; V297-L300 HydrophobicContact CG1-CD1 4.1Å; V297-L300 WeakPolarHBondContact O-CB 3.27Å; V297-L300 PolarHBondContact O-N 3.11Å; V297-P304 HydrophobicContact CG2-CG 4.04Å; V297-F306 HydrophobicContact CG2-CE1 4.15Å; V297-F306 HydrophobicContact CG2-CZ 3.57Å
298	Q	87.9	Confident	91.1	Very high	119 Å²	119	27.8 Å²	27.8	56%	0.556	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-32.7	-178.3	-170.2	-177.7	7.4	0	0	112.1	K193 P294 D295 L300	K193-Q298 PolarHBondContact NZ-O 3.09Å; P294-Q298 PolarHBondContact O-N 3.3Å; D295-Q298 WeakPolarHBondContact O-CB 3.34Å; D295-Q298 PolarHBondContact O-N 3.25Å; D295-Q298 VanDerWaalsContact O-N 3.16Å; D295-Q298 PolarHBondContact OD1-OE1 3.14Å; Q298-L300 PolarHBondContact O-N 3.47Å
299	H	86.9	Confident	91.4	Very high	89 Å²	89	28.3 Å²	28.3	41%	0.412	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-21.6	176.2	67.9	-82.7	0	0	0	112.7	Q244 E267 D296 V297	Q244-H299 PolarHBondContact OE1-CE1 3.27Å; Q244-H299 PolarHBondContact OE1-ND1 3.35Å; E267-H299 IonicContact OE2-NE2 3.49Å; D296-H299 PolarHBondContact O-CE1 2.76Å; D296-H299 PolarHBondContact O-ND1 3.32Å; V297-H299 PolarHBondContact O-N 3.34Å
300	L	90.2	Very high	91.7	Very high	6 Å²	6	28 Å²	28	3%	0.031	14%	0.141	C	C	.	.	S	Bend	trans	-83	150	-178.5	-58.1	179.2	0	0	0	112.1	K193 I240 E267 V271 V297 Q298 L302	K193-L300 WeakPolarHBondContact CE-O 3.44Å; K193-L300 PolarHBondContact NZ-O 3.34Å; I240-L300 HydrophobicContact CB-CD1 4.18Å; I240-L300 HydrophobicContact CG2-CD1 4.34Å; E267-L300 HydrophobicContact CG-CD1 4.29Å; E267-L300 HydrophobicContact CG-CD2 4.17Å; V271-L300 HydrophobicContact CG2-CB 4.41Å; V271-L300 HydrophobicContact CG2-CD1 4.04Å; V271-L300 HydrophobicContact CG2-CD2 4.07Å; V271-L300 HydrophobicContact CG2-CG 4.41Å; V297-L300 HydrophobicContact CB-CD1 4.18Å; V297-L300 HydrophobicContact CG1-CD1 4.1Å; V297-L300 WeakPolarHBondContact O-CB 3.27Å; V297-L300 PolarHBondContact O-N 3.11Å; Q298-L300 PolarHBondContact O-N 3.47Å; L300-L302 HydrophobicContact CB-CD1 4.28Å; L300-L302 HydrophobicContact CB-CG 4.15Å; L300-L302 HydrophobicContact CD1-CD1 4.1Å; L300-L302 PolarHBondContact O-N 2.86Å
301	P	91	Very high	91.9	Very high	40 Å²	40	27.2 Å²	27.2	26%	0.26	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	41.3	177.2	34.5	-35.5	0	0	0	113.9	K193 V194 V195 P196 V271 M275	K193-P301 VanDerWaalsContact CE-CA 3.43Å; V194-P301 WeakPolarHBondContact O-CB 3.31Å; V195-P301 WeakPolarHBondContact CA-O 3.35Å; P196-P301 WeakPolarHBondContact CD-O 3.35Å; V271-P301 HydrophobicContact CG1-CG 3.91Å; M275-P301 HydrophobicContact CE-CB 3.9Å; M275-P301 HydrophobicContact CE-CG 3.74Å; M275-P301 VanDerWaalsContact CE-O 3.27Å; M275-P301 WeakPolarHBondContact CE-O 3.39Å
302	L	92.3	Very high	91.8	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-33.6	-175.1	-66.8	178.3	0	0	0	114	P196 P200 I240 V271 I274 L300 P304	P196-L302 HydrophobicContact CG-CD2 3.84Å; P200-L302 WeakPolarHBondContact CD-O 3.44Å; P200-L302 HydrophobicContact CG-CB 4.1Å; I240-L302 HydrophobicContact CD1-CD1 3.73Å; V271-L302 HydrophobicContact CB-CD2 4.45Å; V271-L302 HydrophobicContact CG1-CD2 3.97Å; V271-L302 HydrophobicContact CG2-CD1 4.26Å; V271-L302 HydrophobicContact CG2-CD2 4.31Å; V271-L302 HydrophobicContact CG2-CG 4.29Å; I274-L302 HydrophobicContact CB-CD2 4.14Å; I274-L302 HydrophobicContact CD1-CD1 4.1Å; I274-L302 HydrophobicContact CD1-CD2 4.28Å; I274-L302 HydrophobicContact CG2-CD2 3.76Å; L300-L302 HydrophobicContact CB-CD1 4.28Å; L300-L302 HydrophobicContact CB-CG 4.15Å; L300-L302 HydrophobicContact CD1-CD1 4.1Å; L300-L302 PolarHBondContact O-N 2.86Å; L302-P304 HydrophobicContact CB-CG 3.98Å
303	S	92.6	Very high	91.9	Very high	16 Å²	16	31.5 Å²	31.5	11%	0.112	17%	0.169	C	C	.	.			trans	39.5	62.5	-171.7	-53.3	0	0	0	0	113	Q102 R199	Q102-S303 PolarHBondContact OE1-OG 3.02Å; R199-S303 PolarHBondContact NE-O 3.2Å
304	P	95.2	Very high	91.9	Very high	9 Å²	9	32.9 Å²	32.9	6%	0.058	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-64.7	160.6	-171	-18	33	0	0	0	113.2	R199 P200 V202 V297 L302 F306	R199-P304 PolarHBondContact NH2-O 3.27Å; P200-P304 HydrophobicContact CG-CB 4.14Å; P200-P304 HydrophobicContact CG-CG 4.31Å; P200-P304 CarbonylContact O-C 3.58Å; P200-P304 VanDerWaalsContact O-CA 3.23Å; P200-P304 WeakPolarHBondContact O-CA 3.36Å; P200-P304 WeakPolarHBondContact O-CB 3.2Å; V202-P304 HydrophobicContact CG2-CB 4.05Å; V297-P304 HydrophobicContact CG2-CG 4.04Å; L302-P304 HydrophobicContact CB-CG 3.98Å; P304-F306 HydrophobicContact CB-CE1 4.05Å; P304-F306 HydrophobicContact CB-CE2 4.09Å; P304-F306 HydrophobicContact CB-CZ 3.81Å; P304-F306 HydrophobicContact CG-CE1 4.28Å; P304-F306 HydrophobicContact CG-CE2 4.24Å; P304-F306 HydrophobicContact CG-CZ 3.75Å
305	I	96.4	Very high	92	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	117.1	163.3	-69.2	165	0	0	0	107.3	R199 P200 I201 V202 F307 E348 Y366 Y370	R199-I305 HydrophobicContact CB-CD1 3.76Å; R199-I305 HydrophobicContact CB-CG1 3.75Å; P200-I305 PolarHBondContact O-N 3.46Å; I201-I305 WeakPolarHBondContact CA-O 3.27Å; I201-I305 HydrophobicContact CG1-CB 4.39Å; I201-I305 HydrophobicContact CG1-CD1 4.48Å; V202-I305 PolarHBondContact N-O 3.35Å; I305-F307 HydrophobicContact CG2-CD1 4.12Å; I305-F307 HydrophobicContact CG2-CE1 3.5Å; I305-F307 HydrophobicContact CG2-CE2 4.09Å; I305-F307 HydrophobicContact CG2-CZ 3.48Å; I305-F307 VanDerWaalsContact CG2-CZ 3.48Å; I305-E348 WeakPolarHBondContact CA-OE2 3.28Å; I305-E348 HydrophobicContact CB-CG 4.47Å; I305-E348 HydrophobicContact CG1-CG 4.42Å; I305-E348 HydrophobicContact CG2-CB 4.02Å; I305-E348 HydrophobicContact CG2-CG 3.88Å; I305-Y366 HydrophobicContact CD1-CE1 4.4Å; I305-Y366 HydrophobicContact CG2-CE1 4.13Å; I305-Y370 HydrophobicContact CD1-CD1 3.82Å; I305-Y370 HydrophobicContact CD1-CD2 4.41Å; I305-Y370 HydrophobicContact CD1-CE1 3.59Å; I305-Y370 HydrophobicContact CD1-CE2 4.25Å; I305-Y370 HydrophobicContact CD1-CG 4.23Å
306	F	96.1	Very high	92.1	Very high	15 Å²	15	41.8 Å²	41.8	7%	0.066	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	123.3	177.8	-62.9	-70.6	0	0	0	111.1	V202 L204 I291 P294 V297 P304 F347 E348	V202-F306 HydrophobicContact CB-CD1 3.87Å; V202-F306 HydrophobicContact CB-CE1 4.02Å; V202-F306 HydrophobicContact CG1-CD1 4.12Å; V202-F306 HydrophobicContact CG1-CE1 4.15Å; V202-F306 HydrophobicContact CG2-CE1 4.41Å; L204-F306 HydrophobicContact CD1-CB 4.1Å; L204-F306 HydrophobicContact CD1-CD1 3.55Å; L204-F306 HydrophobicContact CD1-CE1 4.22Å; L204-F306 HydrophobicContact CD1-CG 4.03Å; L204-F306 HydrophobicContact CD2-CD1 4.4Å; L204-F306 HydrophobicContact CG-CD1 3.96Å; I291-F306 HydrophobicContact CG2-CE1 4.35Å; P294-F306 HydrophobicContact CB-CD2 4.05Å; P294-F306 HydrophobicContact CB-CE2 3.7Å; P294-F306 HydrophobicContact CB-CZ 3.97Å; P294-F306 HydrophobicContact CG-CD2 4.17Å; P294-F306 HydrophobicContact CG-CE2 4.29Å; P294-F306 HydrophobicContact CG-CG 4.35Å; V297-F306 HydrophobicContact CG2-CE1 4.15Å; V297-F306 HydrophobicContact CG2-CZ 3.57Å; P304-F306 HydrophobicContact CB-CE1 4.05Å; P304-F306 HydrophobicContact CB-CE2 4.09Å; P304-F306 HydrophobicContact CB-CZ 3.81Å; P304-F306 HydrophobicContact CG-CE1 4.28Å; P304-F306 HydrophobicContact CG-CE2 4.24Å; P304-F306 HydrophobicContact CG-CZ 3.75Å; F306-F347 HydrophobicContact CB-CD1 3.94Å; F306-E348 PolarHBondContact N-OE2 2.96Å; F306-E348 PolarHBondContact O-N 3.01Å; F306-E348 VanDerWaalsContact O-N 3.08Å
307	F	96.9	Very high	92.3	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	114.8	165.8	-58.6	-41.1	0	0	0	109.2	I201 V202 L203 L204 I305 E348 M349 I351 I363 Y366 L367	I201-F307 HydrophobicContact CG2-CD2 3.67Å; I201-F307 HydrophobicContact CG2-CE2 3.49Å; I201-F307 VanDerWaalsContact CG2-CE2 3.49Å; I201-F307 HydrophobicContact CG2-CZ 4.49Å; V202-F307 PolarHBondContact O-N 3.21Å; L203-F307 HydrophobicContact CD2-CB 3.94Å; L203-F307 HydrophobicContact CD2-CD2 3.96Å; L203-F307 HydrophobicContact CD2-CG 4.47Å; L204-F307 PolarHBondContact N-O 3.14Å; I305-F307 HydrophobicContact CG2-CD1 4.12Å; I305-F307 HydrophobicContact CG2-CE1 3.5Å; I305-F307 HydrophobicContact CG2-CE2 4.09Å; I305-F307 HydrophobicContact CG2-CZ 3.48Å; I305-F307 VanDerWaalsContact CG2-CZ 3.48Å; F307-E348 HydrophobicContact CD1-CB 4.34Å; F307-E348 HydrophobicContact CE1-CB 4.06Å; F307-M349 HydrophobicContact CD1-CB 3.72Å; F307-M349 HydrophobicContact CE1-CB 4.13Å; F307-M349 HydrophobicContact CE1-CE 4.37Å; F307-I351 HydrophobicContact CB-CD1 4.2Å; F307-I363 HydrophobicContact CD2-CG1 4.4Å; F307-I363 HydrophobicContact CD2-CG2 4.01Å; F307-I363 HydrophobicContact CE2-CG2 3.63Å; F307-I363 HydrophobicContact CZ-CG2 4.29Å; F307-Y366 AromaticContact CE1-CD1 3.82Å; F307-Y366 HydrophobicContact CE1-CD1 3.82Å; F307-Y366 HydrophobicContact CE1-CE1 4.01Å; F307-Y366 HydrophobicContact CE1-CG 4.41Å; F307-Y366 AromaticContact CZ-CD1 3.62Å; F307-Y366 HydrophobicContact CZ-CD1 3.62Å; F307-Y366 AromaticContact CZ-CE1 3.98Å; F307-Y366 HydrophobicContact CZ-CE1 3.98Å; F307-Y366 HydrophobicContact CZ-CG 4.48Å; F307-L367 HydrophobicContact CE2-CD1 4.41Å; F307-L367 HydrophobicContact CE2-CD2 4.11Å; F307-L367 HydrophobicContact CE2-CG 4.3Å; F307-L367 HydrophobicContact CZ-CD2 3.96Å; F307-L367 HydrophobicContact CZ-CG 4.28Å
308	L	96.3	Very high	92.4	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	121	178.2	177.6	65.1	0	0	0	109.8	L204 R310 L339 F347 M349 V350 I351	L204-L308 HydrophobicContact CB-CD1 4.03Å; L308-R310 HydrophobicContact CG-CB 4.47Å; L308-L339 HydrophobicContact CD1-CB 4.32Å; L308-L339 HydrophobicContact CD1-CD1 4.21Å; L308-L339 HydrophobicContact CD1-CD2 4.22Å; L308-L339 HydrophobicContact CD1-CG 4.49Å; L308-F347 HydrophobicContact CB-CB 4.47Å; L308-F347 HydrophobicContact CB-CD1 3.88Å; L308-F347 HydrophobicContact CB-CD2 4.4Å; L308-F347 HydrophobicContact CB-CE1 4.2Å; L308-F347 HydrophobicContact CB-CG 3.99Å; L308-F347 HydrophobicContact CD2-CD2 4.05Å; L308-F347 HydrophobicContact CD2-CE1 4.32Å; L308-F347 HydrophobicContact CD2-CE2 3.78Å; L308-F347 HydrophobicContact CD2-CG 4.45Å; L308-F347 HydrophobicContact CD2-CZ 3.93Å; L308-M349 PolarHBondContact N-O 3.42Å; L308-V350 HydrophobicContact CB-CG2 4.42Å; L308-V350 HydrophobicContact CD2-CG1 4.26Å; L308-V350 HydrophobicContact CD2-CG2 4.29Å; L308-V350 HydrophobicContact CG-CG1 4.49Å; L308-V350 CarbonylContact O-C 3.6Å; L308-V350 WeakPolarHBondContact O-CA 3.03Å; L308-I351 PolarHBondContact O-N 3.28Å
309	I	95.5	Very high	92.6	Very high	15 Å²	15	41.7 Å²	41.7	8%	0.077	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	118.3	170	-63.1	145.4	0	0	0	107.3	L203 L204 P206 H218 L221 I351	L203-I309 HydrophobicContact CB-CD1 4.37Å; L204-I309 PolarHBondContact O-N 2.96Å; P206-I309 WeakPolarHBondContact CA-O 3.44Å; H218-I309 WeakPolarHBondContact CD2-CD1 3.41Å; H218-I309 VanDerWaalsContact NE2-CD1 3.33Å; H218-I309 WeakPolarHBondContact NE2-CD1 3.49Å; L221-I309 HydrophobicContact CD1-CD1 3.35Å; L221-I309 HydrophobicContact CD1-CG1 3.85Å; I309-I351 HydrophobicContact CG1-CB 4.46Å; I309-I351 HydrophobicContact CG1-CD1 4.19Å
310	R	93.5	Very high	92.8	Very high	47 Å²	47	40.3 Å²	40.3	18%	0.177	21%	0.209	C	C	.	.			trans	-124	126.2	-173.6	-171.9	169.8	80.6	-171.5	-2.4	110.2	L308 K340 D344 V350 I351 E352	L308-R310 HydrophobicContact CG-CB 4.47Å; R310-K340 HydrophobicContact CG-CG 4.03Å; R310-D344 IonicContact NH1-OD1 3.56Å; R310-D344 PolarHBondContact NH1-OD1 2.99Å; R310-D344 IonicContact NH1-OD2 2.69Å; R310-V350 HydrophobicContact CB-CG1 3.92Å; R310-I351 PolarHBondContact N-O 3.46Å; R310-E352 HydrophobicContact CB-CG 4.29Å; R310-E352 IonicContact CZ-OE1 3.5Å; R310-E352 IonicContact NE-OE1 3.33Å; R310-E352 PolarHBondContact NE-OE1 2.97Å; R310-E352 IonicContact NH2-OE1 3.78Å; R310-E352 PolarHBondContact NH2-OE1 2.82Å; R310-E352 IonicContact NH2-OE2 3.86Å; R310-E352 PolarHBondContact NH2-OE2 3.24Å
311	V	92.3	Very high	92.9	Very high	28 Å²	28	40 Å²	40	17%	0.17	21%	0.208	C	C	.	.			trans	-96.1	105.3	170.1	180	0	0	0	0	108	P206 D313 I316 L317 K340	P206-V311 HydrophobicContact CB-CG2 3.84Å; P206-V311 HydrophobicContact CG-CG2 4.24Å; V311-D313 PolarHBondContact O-N 3.35Å; V311-I316 HydrophobicContact CG1-CB 4.42Å; V311-I316 HydrophobicContact CG1-CG2 4.28Å; V311-L317 HydrophobicContact CB-CB 4.47Å; V311-L317 HydrophobicContact CB-CD1 4.36Å; V311-L317 HydrophobicContact CG1-CB 4.03Å; V311-L317 HydrophobicContact CG2-CD1 4.39Å; V311-K340 WeakPolarHBondContact O-CE 3.47Å; V311-K340 PolarHBondContact O-NZ 3.47Å
312	S	88.4	Confident	92.9	Very high	72 Å²	72	45.7 Å²	45.7	50%	0.503	22%	0.224	S	C	.	.			trans	-62.5	-41.6	-171.5	-38	0	0	0	0	112.5	K340 E352	S312-K340 PolarHBondContact O-NZ 2.97Å; S312-E352 PolarHBondContact OG-OE1 3.03Å
313	D	91.4	Very high	92.9	Very high	71 Å²	71	51.7 Å²	51.7	38%	0.38	26%	0.256	S	S	.	.			trans	-91.3	120.2	-179.5	-171.9	-7.2	0	0	0	113.2	V311 K315 I316 L317	V311-D313 PolarHBondContact O-N 3.35Å; D313-K315 VanDerWaalsContact C-N 3.29Å; D313-K315 PolarHBondContact O-N 2.98Å; D313-K315 WeakPolarHBondContact OD1-CB 3.07Å; D313-K315 PolarHBondContact OD1-N 3.24Å; D313-I316 HydrophobicContact CB-CB 4.17Å; D313-I316 HydrophobicContact CB-CD1 3.86Å; D313-I316 HydrophobicContact CB-CG1 3.89Å; D313-I316 PolarHBondContact O-N 2.87Å; D313-L317 PolarHBondContact O-N 3.08Å
314	N	89.8	Confident	92.7	Very high	57 Å²	57	52.6 Å²	52.6	31%	0.305	26%	0.261	S	S	.	.	H	α-helix	trans	-65.6	-27	176.2	-76.3	-14.4	0	0	0	113.6	A318 N337 K340	N314-A318 VanDerWaalsContact O-CB 3.31Å; N314-A318 WeakPolarHBondContact O-CB 3.28Å; N314-A318 PolarHBondContact O-N 2.89Å; N314-N337 PolarHBondContact ND2-OD1 3.07Å; N314-N337 PolarHBondContact OD1-OD1 2.85Å; N314-K340 PolarHBondContact OD1-NZ 3.49Å
315	K	91.9	Very high	92.2	Very high	169 Å²	169	55 Å²	55	74%	0.735	29%	0.288	S	S	*	.	H	α-helix	trans	-68.9	-42.2	175	-64	177.4	-179.4	174.3	0	111	D313 A318 K319	D313-K315 VanDerWaalsContact C-N 3.29Å; D313-K315 PolarHBondContact O-N 2.98Å; D313-K315 WeakPolarHBondContact OD1-CB 3.07Å; D313-K315 PolarHBondContact OD1-N 3.24Å; K315-A318 PolarHBondContact O-N 2.94Å; K315-K319 PolarHBondContact O-N 3.37Å
316	I	92.6	Very high	91.5	Very high	85 Å²	85	56 Å²	56	44%	0.436	29%	0.294	S	S	.	.	H	α-helix	trans	-64.4	-47.9	174.6	-62.4	178.6	0	0	0	109.1	V311 D313 A318 K319 L320	V311-I316 HydrophobicContact CG1-CB 4.42Å; V311-I316 HydrophobicContact CG1-CG2 4.28Å; D313-I316 HydrophobicContact CB-CB 4.17Å; D313-I316 HydrophobicContact CB-CD1 3.86Å; D313-I316 HydrophobicContact CB-CG1 3.89Å; D313-I316 PolarHBondContact O-N 2.87Å; I316-A318 VanDerWaalsContact C-N 3.35Å; I316-A318 PolarHBondContact O-N 2.63Å; I316-K319 WeakPolarHBondContact O-CB 3.27Å; I316-K319 PolarHBondContact O-N 2.8Å; I316-L320 HydrophobicContact CG2-CD1 4.07Å; I316-L320 HydrophobicContact CG2-CG 4.32Å; I316-L320 WeakPolarHBondContact O-CG 3.35Å; I316-L320 PolarHBondContact O-N 3.24Å
317	L	92.3	Very high	90.6	Very high	1 Å²	1	61.7 Å²	61.7	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-55.8	-48	176.9	-177.2	60.5	0	0	0	111.9	T207 L213 V311 D313 K319 L320 L321 I333 A336	T207-L317 HydrophobicContact CG2-CD1 3.78Å; T207-L317 HydrophobicContact CG2-CD2 4.07Å; T207-L317 HydrophobicContact CG2-CG 4.37Å; L213-L317 HydrophobicContact CD2-CD1 3.68Å; V311-L317 HydrophobicContact CB-CB 4.47Å; V311-L317 HydrophobicContact CB-CD1 4.36Å; V311-L317 HydrophobicContact CG1-CB 4.03Å; V311-L317 HydrophobicContact CG2-CD1 4.39Å; D313-L317 PolarHBondContact O-N 3.08Å; L317-K319 VanDerWaalsContact C-N 3.28Å; L317-K319 PolarHBondContact O-N 3.17Å; L317-L320 PolarHBondContact O-N 3.02Å; L317-L320 VanDerWaalsContact O-N 3.15Å; L317-L321 HydrophobicContact CD1-CD1 4.44Å; L317-L321 HydrophobicContact CD1-CG 4.35Å; L317-L321 HydrophobicContact CG-CD1 4.15Å; L317-L321 HydrophobicContact CG-CG 4.48Å; L317-L321 VanDerWaalsContact O-CG 3.32Å; L317-L321 WeakPolarHBondContact O-CG 3.22Å; L317-L321 PolarHBondContact O-N 3.32Å; L317-I333 HydrophobicContact CD2-CG1 4.37Å; L317-A336 HydrophobicContact CD2-CB 3.5Å
318	A	91.4	Very high	89.8	Confident	22 Å²	22	70 Å²	70	18%	0.182	36%	0.361	C	S	.	.	H	α-helix	trans	-62.9	-31.8	177.2	0	0	0	0	0	113.1	N314 K315 I316 R322 I333	N314-A318 VanDerWaalsContact O-CB 3.31Å; N314-A318 WeakPolarHBondContact O-CB 3.28Å; N314-A318 PolarHBondContact O-N 2.89Å; K315-A318 PolarHBondContact O-N 2.94Å; I316-A318 VanDerWaalsContact C-N 3.35Å; I316-A318 PolarHBondContact O-N 2.63Å; A318-R322 WeakPolarHBondContact O-CG 3.46Å; A318-R322 PolarHBondContact O-N 3.21Å; A318-R322 PolarHBondContact O-NE 2.9Å; A318-I333 HydrophobicContact CB-CD1 4.21Å
319	K	91.9	Very high	89.3	Confident	133 Å²	133	73.1 Å²	73.1	58%	0.578	38%	0.376	S	S	*	.	H	α-helix	trans	-69.8	-43.6	172.9	-171.1	177.6	179.5	-179.1	0	111.3	K315 I316 L317 R322 N323	K315-K319 PolarHBondContact O-N 3.37Å; I316-K319 WeakPolarHBondContact O-CB 3.27Å; I316-K319 PolarHBondContact O-N 2.8Å; L317-K319 VanDerWaalsContact C-N 3.28Å; L317-K319 PolarHBondContact O-N 3.17Å; K319-R322 PolarHBondContact O-N 3.29Å; K319-N323 PolarHBondContact O-N 3.27Å; K319-N323 VanDerWaalsContact O-N 3.08Å; K319-N323 PolarHBondContact O-OD1 3.41Å
320	L	91.8	Very high	88.8	Confident	61 Å²	61	76.3 Å²	76.3	32%	0.319	41%	0.405	S	S	.	.	H	α-helix	trans	-61.5	-44.5	176.8	-67.3	174.1	0	0	0	111.5	L213 I316 L317 R322 N323 T324	L213-L320 HydrophobicContact CD1-CB 3.98Å; L213-L320 HydrophobicContact CD2-CB 3.8Å; I316-L320 HydrophobicContact CG2-CD1 4.07Å; I316-L320 HydrophobicContact CG2-CG 4.32Å; I316-L320 WeakPolarHBondContact O-CG 3.35Å; I316-L320 PolarHBondContact O-N 3.24Å; L317-L320 PolarHBondContact O-N 3.02Å; L317-L320 VanDerWaalsContact O-N 3.15Å; L320-R322 PolarHBondContact O-N 3.49Å; L320-N323 WeakPolarHBondContact O-CB 3.36Å; L320-N323 PolarHBondContact O-N 2.73Å; L320-T324 PolarHBondContact O-N 3.45Å; L320-T324 VanDerWaalsContact O-N 3.07Å; L320-T324 PolarHBondContact O-OG1 3.5Å
321	L	92.5	Very high	88.5	Confident	0 Å²	0	75.5 Å²	75.5	0%	0	41%	0.409	C	S	.	.	H	α-helix	trans	-63.6	-37.5	177.8	-68.7	176.1	0	0	0	113.3	L213 L317 T324 G325 T326 M329 E332 I333	L213-L321 HydrophobicContact CB-CD2 3.96Å; L213-L321 HydrophobicContact CD2-CD2 3.65Å; L213-L321 HydrophobicContact CD2-CG 4.1Å; L213-L321 HydrophobicContact CG-CD2 4.47Å; L317-L321 HydrophobicContact CD1-CD1 4.44Å; L317-L321 HydrophobicContact CD1-CG 4.35Å; L317-L321 HydrophobicContact CG-CD1 4.15Å; L317-L321 HydrophobicContact CG-CG 4.48Å; L317-L321 VanDerWaalsContact O-CG 3.32Å; L317-L321 WeakPolarHBondContact O-CG 3.22Å; L317-L321 PolarHBondContact O-N 3.32Å; L321-T324 WeakPolarHBondContact CA-OG1 3.26Å; L321-T324 PolarHBondContact O-N 2.93Å; L321-T324 PolarHBondContact O-OG1 3.44Å; L321-G325 PolarHBondContact O-N 3.21Å; L321-T326 WeakPolarHBondContact O-CB 3.26Å; L321-T326 PolarHBondContact O-N 3.43Å; L321-T326 VanDerWaalsContact O-N 3.16Å; L321-M329 HydrophobicContact CB-CG 4.16Å; L321-M329 HydrophobicContact CB-SD 4.4Å; L321-E332 HydrophobicContact CD1-CB 3.93Å; L321-E332 HydrophobicContact CD2-CB 4.43Å; L321-E332 WeakPolarHBondContact CD2-OE2 3.33Å; L321-I333 HydrophobicContact CD1-CD1 4.49Å; L321-I333 HydrophobicContact CD1-CG1 3.94Å
322	R	90.6	Very high	88.4	Confident	159 Å²	159	74.7 Å²	74.7	60%	0.6	40%	0.403	S	S	*	.	H	α-helix	trans	-64.2	-42.2	173.3	-77.7	-176.5	-73.4	-169.9	0.1	111.5	A318 K319 L320 T324 G325 M329	A318-R322 WeakPolarHBondContact O-CG 3.46Å; A318-R322 PolarHBondContact O-N 3.21Å; A318-R322 PolarHBondContact O-NE 2.9Å; K319-R322 PolarHBondContact O-N 3.29Å; L320-R322 PolarHBondContact O-N 3.49Å; R322-T324 VanDerWaalsContact C-N 3.25Å; R322-T324 PolarHBondContact O-N 3.37Å; R322-G325 PolarHBondContact O-N 3.36Å; R322-G325 VanDerWaalsContact O-N 3.11Å; R322-M329 HydrophobicContact CG-CE 4.2Å; R322-M329 HydrophobicContact CG-SD 3.47Å; R322-M329 WeakPolarHBondContact CG-SD 3.31Å
323	N	91.3	Very high	88.4	Confident	125 Å²	125	73.2 Å²	73.2	67%	0.668	39%	0.389	S	S	*	.	H	α-helix	trans	-65.2	-29.1	178.4	-71.3	-2.1	0	0	0	112.7	K319 L320 G325	K319-N323 PolarHBondContact O-N 3.27Å; K319-N323 VanDerWaalsContact O-N 3.08Å; K319-N323 PolarHBondContact O-OD1 3.41Å; L320-N323 WeakPolarHBondContact O-CB 3.36Å; L320-N323 PolarHBondContact O-N 2.73Å; N323-G325 VanDerWaalsContact C-N 3.26Å; N323-G325 PolarHBondContact O-N 2.95Å
324	T	89.1	Confident	88.4	Confident	35 Å²	35	76.1 Å²	76.1	22%	0.215	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-1.4	176.2	56.3	0	0	0	0	113.8	L213 L216 L320 L321 R322 T326	L213-T324 HydrophobicContact CB-CG2 4.07Å; L213-T324 HydrophobicContact CD1-CG2 4.2Å; L216-T324 HydrophobicContact CD1-CG2 4.31Å; L320-T324 PolarHBondContact O-N 3.45Å; L320-T324 VanDerWaalsContact O-N 3.07Å; L320-T324 PolarHBondContact O-OG1 3.5Å; L321-T324 WeakPolarHBondContact CA-OG1 3.26Å; L321-T324 PolarHBondContact O-N 2.93Å; L321-T324 PolarHBondContact O-OG1 3.44Å; R322-T324 VanDerWaalsContact C-N 3.25Å; R322-T324 PolarHBondContact O-N 3.37Å; T324-T326 VanDerWaalsContact C-N 3.31Å; T324-T326 PolarHBondContact OG1-OG1 3.1Å
325	G	83.6	Confident	88.3	Confident	61 Å²	61	75.1 Å²	75.1	63%	0.629	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.1	21.2	-179.2	0	0	0	0	0	113.9	L321 R322 N323 T327	L321-G325 PolarHBondContact O-N 3.21Å; R322-G325 PolarHBondContact O-N 3.36Å; R322-G325 VanDerWaalsContact O-N 3.11Å; N323-G325 VanDerWaalsContact C-N 3.26Å; N323-G325 PolarHBondContact O-N 2.95Å; G325-T327 PolarHBondContact O-N 3.4Å
326	T	81.8	Confident	88.3	Confident	20 Å²	20	67.2 Å²	67.2	12%	0.123	36%	0.362	C	S	.	.			trans	-71.4	123.7	-178.7	-67.7	0	0	0	0	110.7	L321 T324 M329 E332	L321-T326 WeakPolarHBondContact O-CB 3.26Å; L321-T326 PolarHBondContact O-N 3.43Å; L321-T326 VanDerWaalsContact O-N 3.16Å; T324-T326 VanDerWaalsContact C-N 3.31Å; T324-T326 PolarHBondContact OG1-OG1 3.1Å; T326-M329 HydrophobicContact CG2-CG 4.31Å; T326-M329 WeakPolarHBondContact O-CG 3.44Å; T326-E332 HydrophobicContact CG2-CG 4.47Å; T326-E332 WeakPolarHBondContact CG2-OE1 3.4Å
327	T	76.9	Confident	88.2	Confident	134 Å²	134	66 Å²	66	82%	0.822	36%	0.357	S	S	*	.	S	Bend	trans	-83.9	-27.6	176.8	55.4	0	0	0	0	113.3	G325 M329	G325-T327 PolarHBondContact O-N 3.4Å; T327-M329 PolarHBondContact O-N 3.44Å
328	R	81.4	Confident	88.1	Confident	175 Å²	175	69.4 Å²	69.4	66%	0.66	38%	0.377	S	S	*	.			trans	-97.5	46.8	-174.8	-61.2	-178.1	67.8	-175.2	-1	113.5	A330 A331 E332	R328-A330 VanDerWaalsContact C-N 3.33Å; R328-A330 PolarHBondContact O-N 3.49Å; R328-A331 PolarHBondContact O-N 3.28Å; R328-E332 PolarHBondContact O-N 3.4Å
329	M	84.4	Confident	88	Confident	65 Å²	65	68.6 Å²	68.6	32%	0.32	37%	0.37	S	S	.	.	H	α-helix	trans	-60	-36.8	-172.4	-63.3	-174.1	-73.9	0	0	114.3	L321 R322 T326 T327 A331 E332 I333	L321-M329 HydrophobicContact CB-CG 4.16Å; L321-M329 HydrophobicContact CB-SD 4.4Å; R322-M329 HydrophobicContact CG-CE 4.2Å; R322-M329 HydrophobicContact CG-SD 3.47Å; R322-M329 WeakPolarHBondContact CG-SD 3.31Å; T326-M329 HydrophobicContact CG2-CG 4.31Å; T326-M329 WeakPolarHBondContact O-CG 3.44Å; T327-M329 PolarHBondContact O-N 3.44Å; M329-A331 PolarHBondContact O-N 3.48Å; M329-E332 PolarHBondContact O-N 3.43Å; M329-I333 VanDerWaalsContact O-CG1 3.31Å; M329-I333 WeakPolarHBondContact O-CG1 3.49Å; M329-I333 PolarHBondContact O-N 3.05Å
330	A	86.8	Confident	87.9	Confident	83 Å²	83	64.6 Å²	64.6	69%	0.686	35%	0.353	S	S	*	.	H	α-helix	trans	-60.7	-47.1	-177.6	0	0	0	0	0	112.3	R328 E332 I333 E334	R328-A330 VanDerWaalsContact C-N 3.33Å; R328-A330 PolarHBondContact O-N 3.49Å; A330-E332 VanDerWaalsContact C-N 3.32Å; A330-E332 PolarHBondContact O-N 3.47Å; A330-I333 PolarHBondContact O-N 2.85Å; A330-E334 WeakPolarHBondContact O-CB 3.26Å; A330-E334 PolarHBondContact O-N 3.14Å
331	A	87.3	Confident	87.8	Confident	30 Å²	30	67.2 Å²	67.2	25%	0.248	37%	0.372	C	S	.	.	H	α-helix	trans	-65	-36.1	178.5	0	0	0	0	0	112.2	R328 M329 V335	R328-A331 PolarHBondContact O-N 3.28Å; M329-A331 PolarHBondContact O-N 3.48Å; A331-V335 WeakPolarHBondContact O-CG2 3.35Å; A331-V335 PolarHBondContact O-N 2.86Å; A331-V335 VanDerWaalsContact O-N 3.15Å
332	E	88.6	Confident	87.6	Confident	10 Å²	10	69 Å²	69	5%	0.047	38%	0.38	C	S	.	.	H	α-helix	trans	-69.6	-40	177.6	-70.7	-160.1	-148.3	0	0	113	T207 L208 S211 L321 T326 R328 M329 A330 A336	T207-E332 HydrophobicContact CG2-CB 4.05Å; T207-E332 WeakPolarHBondContact CG2-O 3.22Å; T207-E332 PolarHBondContact OG1-OE2 2.96Å; L208-E332 HydrophobicContact CD1-CG 4.07Å; S211-E332 WeakPolarHBondContact CB-OE2 3.13Å; S211-E332 PolarHBondContact OG-OE1 3.34Å; S211-E332 PolarHBondContact OG-OE2 3.47Å; L321-E332 HydrophobicContact CD1-CB 3.93Å; L321-E332 HydrophobicContact CD2-CB 4.43Å; L321-E332 WeakPolarHBondContact CD2-OE2 3.33Å; T326-E332 HydrophobicContact CG2-CG 4.47Å; T326-E332 WeakPolarHBondContact CG2-OE1 3.4Å; R328-E332 PolarHBondContact O-N 3.4Å; M329-E332 PolarHBondContact O-N 3.43Å; A330-E332 VanDerWaalsContact C-N 3.32Å; A330-E332 PolarHBondContact O-N 3.47Å; E332-A336 PolarHBondContact O-N 2.96Å
333	I	89.9	Confident	87.5	Confident	41 Å²	41	65.9 Å²	65.9	21%	0.21	38%	0.375	C	S	.	.	H	α-helix	trans	-67.8	-38.5	176	-67.5	167.5	0	0	0	110.6	L317 A318 L321 M329 A330 A336 N337	L317-I333 HydrophobicContact CD2-CG1 4.37Å; A318-I333 HydrophobicContact CB-CD1 4.21Å; L321-I333 HydrophobicContact CD1-CD1 4.49Å; L321-I333 HydrophobicContact CD1-CG1 3.94Å; M329-I333 VanDerWaalsContact O-CG1 3.31Å; M329-I333 WeakPolarHBondContact O-CG1 3.49Å; M329-I333 PolarHBondContact O-N 3.05Å; A330-I333 PolarHBondContact O-N 2.85Å; I333-A336 PolarHBondContact O-N 2.93Å; I333-N337 VanDerWaalsContact O-CG 3.25Å; I333-N337 PolarHBondContact O-N 3.36Å; I333-N337 PolarHBondContact O-ND2 2.93Å
334	E	89.6	Confident	87.4	Confident	132 Å²	132	63.3 Å²	63.3	62%	0.617	36%	0.362	S	S	*	.	H	α-helix	trans	-59	-48.8	175.4	-176.4	174.4	-161.5	0	0	111.5	A330 A336 N337 V338	A330-E334 WeakPolarHBondContact O-CB 3.26Å; A330-E334 PolarHBondContact O-N 3.14Å; E334-A336 VanDerWaalsContact C-N 3.35Å; E334-A336 PolarHBondContact O-N 3.43Å; E334-N337 WeakPolarHBondContact O-CB 3.37Å; E334-N337 PolarHBondContact O-N 2.9Å; E334-N337 VanDerWaalsContact O-N 3.1Å; E334-V338 PolarHBondContact O-N 2.85Å
335	V	89.2	Confident	87.4	Confident	36 Å²	36	68.3 Å²	68.3	22%	0.218	39%	0.387	C	S	.	.	H	α-helix	trans	-62.5	-41.9	176.6	172	0	0	0	0	111.6	L208 A331 N337 V338 L339	L208-V335 HydrophobicContact CD2-CB 4.38Å; L208-V335 HydrophobicContact CD2-CG1 4.23Å; L208-V335 HydrophobicContact CD2-CG2 3.72Å; L208-V335 HydrophobicContact CG-CB 4.33Å; L208-V335 HydrophobicContact CG-CG1 4.4Å; L208-V335 HydrophobicContact CG-CG2 3.99Å; A331-V335 WeakPolarHBondContact O-CG2 3.35Å; A331-V335 PolarHBondContact O-N 2.86Å; A331-V335 VanDerWaalsContact O-N 3.15Å; V335-N337 VanDerWaalsContact C-N 3.26Å; V335-N337 PolarHBondContact O-N 3.2Å; V335-V338 PolarHBondContact O-N 3.43Å; V335-L339 HydrophobicContact CG1-CD1 4.39Å; V335-L339 WeakPolarHBondContact O-CG 3.39Å; V335-L339 PolarHBondContact O-N 2.93Å
336	A	91.1	Very high	87.6	Confident	3 Å²	3	70.4 Å²	70.4	3%	0.025	38%	0.376	C	S	.	.	H	α-helix	trans	-59.9	-37.2	174.3	0	0	0	0	0	112.5	P206 T207 L317 E332 I333 E334 L339 K340	P206-A336 WeakPolarHBondContact O-CA 3.42Å; P206-A336 VanDerWaalsContact O-CB 3.23Å; P206-A336 WeakPolarHBondContact O-CB 3.35Å; T207-A336 HydrophobicContact CG2-CB 4.12Å; L317-A336 HydrophobicContact CD2-CB 3.5Å; E332-A336 PolarHBondContact O-N 2.96Å; I333-A336 PolarHBondContact O-N 2.93Å; E334-A336 VanDerWaalsContact C-N 3.35Å; E334-A336 PolarHBondContact O-N 3.43Å; A336-L339 PolarHBondContact O-N 3.15Å; A336-K340 VanDerWaalsContact O-CG 3.24Å; A336-K340 WeakPolarHBondContact O-CG 3.33Å; A336-K340 PolarHBondContact O-N 3.01Å
337	N	90.8	Very high	88.1	Confident	59 Å²	59	70.1 Å²	70.1	32%	0.316	37%	0.373	S	S	.	.	H	α-helix	trans	-68.2	-40.3	175.8	-69.1	-32.2	0	0	0	111.6	N314 I333 E334 V335 L339 K340 T341	N314-N337 PolarHBondContact ND2-OD1 3.07Å; N314-N337 PolarHBondContact OD1-OD1 2.85Å; I333-N337 VanDerWaalsContact O-CG 3.25Å; I333-N337 PolarHBondContact O-N 3.36Å; I333-N337 PolarHBondContact O-ND2 2.93Å; E334-N337 WeakPolarHBondContact O-CB 3.37Å; E334-N337 PolarHBondContact O-N 2.9Å; E334-N337 VanDerWaalsContact O-N 3.1Å; V335-N337 VanDerWaalsContact C-N 3.26Å; V335-N337 PolarHBondContact O-N 3.2Å; N337-L339 VanDerWaalsContact C-N 3.34Å; N337-L339 PolarHBondContact O-N 3.36Å; N337-K340 WeakPolarHBondContact O-CB 3.37Å; N337-K340 PolarHBondContact O-N 3.38Å; N337-K340 VanDerWaalsContact O-N 3.16Å; N337-T341 WeakPolarHBondContact O-CG2 3.26Å; N337-T341 PolarHBondContact O-N 3.07Å; N337-T341 PolarHBondContact O-OG1 3.36Å
338	V	90.6	Very high	88.9	Confident	73 Å²	73	66.5 Å²	66.5	44%	0.442	35%	0.347	S	S	.	.	H	α-helix	trans	-58.3	-48.3	173.5	174	0	0	0	0	110.5	E334 V335 K340 T341 M342	E334-V338 PolarHBondContact O-N 2.85Å; V335-V338 PolarHBondContact O-N 3.43Å; V338-K340 VanDerWaalsContact C-N 3.26Å; V338-K340 PolarHBondContact O-N 2.93Å; V338-T341 PolarHBondContact O-N 3.45Å; V338-T341 VanDerWaalsContact O-N 3.09Å; V338-T341 PolarHBondContact O-OG1 2.89Å; V338-M342 PolarHBondContact O-N 3.36Å
339	L	89.1	Confident	89.6	Confident	6 Å²	6	59.1 Å²	59.1	3%	0.031	32%	0.32	C	S	.	.	H	α-helix	trans	-59	-35.2	176.7	-68.5	174.9	0	0	0	112.6	L308 V335 A336 N337 M342	L308-L339 HydrophobicContact CD1-CB 4.32Å; L308-L339 HydrophobicContact CD1-CD1 4.21Å; L308-L339 HydrophobicContact CD1-CD2 4.22Å; L308-L339 HydrophobicContact CD1-CG 4.49Å; V335-L339 HydrophobicContact CG1-CD1 4.39Å; V335-L339 WeakPolarHBondContact O-CG 3.39Å; V335-L339 PolarHBondContact O-N 2.93Å; A336-L339 PolarHBondContact O-N 3.15Å; N337-L339 VanDerWaalsContact C-N 3.34Å; N337-L339 PolarHBondContact O-N 3.36Å; L339-M342 HydrophobicContact CB-CE 4.44Å; L339-M342 HydrophobicContact CD2-CE 3.25Å; L339-M342 HydrophobicContact CG-CE 4.29Å
340	K	89.1	Confident	90.1	Very high	49 Å²	49	57 Å²	57	21%	0.213	31%	0.311	C	S	.	.	H	α-helix	trans	-70	-31.4	175.8	-73.6	169.5	-175.5	-167.5	0	113.6	R310 V311 S312 N314 A336 N337 V338	R310-K340 HydrophobicContact CG-CG 4.03Å; V311-K340 WeakPolarHBondContact O-CE 3.47Å; V311-K340 PolarHBondContact O-NZ 3.47Å; S312-K340 PolarHBondContact O-NZ 2.97Å; N314-K340 PolarHBondContact OD1-NZ 3.49Å; A336-K340 VanDerWaalsContact O-CG 3.24Å; A336-K340 WeakPolarHBondContact O-CG 3.33Å; A336-K340 PolarHBondContact O-N 3.01Å; N337-K340 WeakPolarHBondContact O-CB 3.37Å; N337-K340 PolarHBondContact O-N 3.38Å; N337-K340 VanDerWaalsContact O-N 3.16Å; V338-K340 VanDerWaalsContact C-N 3.26Å; V338-K340 PolarHBondContact O-N 2.93Å
341	T	89.8	Confident	90.5	Very high	116 Å²	116	53.3 Å²	53.3	71%	0.712	28%	0.28	S	S	*	.	H	α-helix	trans	-84.4	-12.9	-178.3	55.3	0	0	0	0	113.8	N337 V338	N337-T341 WeakPolarHBondContact O-CG2 3.26Å; N337-T341 PolarHBondContact O-N 3.07Å; N337-T341 PolarHBondContact O-OG1 3.36Å; V338-T341 PolarHBondContact O-N 3.45Å; V338-T341 VanDerWaalsContact O-N 3.09Å; V338-T341 PolarHBondContact O-OG1 2.89Å
342	M	87.9	Confident	90.8	Very high	37 Å²	37	55.6 Å²	55.6	18%	0.182	29%	0.285	C	S	.	.	S	Bend	trans	-69.2	151.3	177.6	-75.7	-160.8	-81.1	0	0	111.8	T293 V338 L339 D344 F347	T293-M342 HydrophobicContact CG2-CE 3.91Å; T293-M342 HydrophobicContact CG2-SD 4.43Å; V338-M342 PolarHBondContact O-N 3.36Å; L339-M342 HydrophobicContact CB-CE 4.44Å; L339-M342 HydrophobicContact CD2-CE 3.25Å; L339-M342 HydrophobicContact CG-CE 4.29Å; M342-D344 PolarHBondContact O-N 3.34Å; M342-F347 HydrophobicContact CB-CE2 4.2Å; M342-F347 HydrophobicContact CB-CZ 4.3Å; M342-F347 HydrophobicContact CE-CZ 3.85Å; M342-F347 HydrophobicContact SD-CZ 4.39Å
343	N	90	Very high	91	Very high	93 Å²	93	58.1 Å²	58.1	50%	0.497	30%	0.297	S	S	.	.			trans	-67.3	128.9	175.8	-174.9	5.3	0	0	0	110.4	D345 R346	N343-D345 PolarHBondContact ND2-OD2 3.33Å; N343-D345 PolarHBondContact O-N 3.09Å; N343-D345 PolarHBondContact OD1-N 2.83Å; N343-D345 PolarHBondContact OD1-OD2 3.47Å; N343-R346 WeakPolarHBondContact O-CB 3.47Å; N343-R346 WeakPolarHBondContact O-CG 3.43Å; N343-R346 PolarHBondContact O-N 3.16Å; N343-R346 VanDerWaalsContact O-N 3.16Å
344	D	88.8	Confident	91	Very high	72 Å²	72	64.4 Å²	64.4	39%	0.385	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-61.9	-23.2	-179.9	-72.8	-12.9	0	0	0	112.2	R310 M342 R346 F347 V350	R310-D344 IonicContact NH1-OD1 3.56Å; R310-D344 PolarHBondContact NH1-OD1 2.99Å; R310-D344 IonicContact NH1-OD2 2.69Å; M342-D344 PolarHBondContact O-N 3.34Å; D344-R346 PolarHBondContact O-N 2.69Å; D344-R346 VanDerWaalsContact O-N 3.07Å; D344-F347 PolarHBondContact O-N 3.16Å; D344-V350 HydrophobicContact CB-CG2 4.37Å
345	D	88	Confident	91.2	Very high	140 Å²	140	59.2 Å²	59.2	75%	0.749	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-61.2	-16.9	175.8	-62.7	-29.8	0	0	0	114	N343	N343-D345 PolarHBondContact ND2-OD2 3.33Å; N343-D345 PolarHBondContact O-N 3.09Å; N343-D345 PolarHBondContact OD1-N 2.83Å; N343-D345 PolarHBondContact OD1-OD2 3.47Å
346	R	88.2	Confident	91.5	Very high	104 Å²	104	61.4 Å²	61.4	39%	0.392	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-78.4	-10.2	177	-59.4	-65.9	-63.7	-98.1	-2.2	112.6	P294 D295 N343 D344	P294-R346 HydrophobicContact CG-CB 4.45Å; D295-R346 IonicContact OD1-CZ 3.47Å; D295-R346 IonicContact OD1-NH1 3.48Å; D295-R346 PolarHBondContact OD1-NH1 2.93Å; D295-R346 IonicContact OD1-NH2 3.19Å; D295-R346 PolarHBondContact OD1-NH2 3.46Å; N343-R346 WeakPolarHBondContact O-CB 3.47Å; N343-R346 WeakPolarHBondContact O-CG 3.43Å; N343-R346 PolarHBondContact O-N 3.16Å; N343-R346 VanDerWaalsContact O-N 3.16Å; D344-R346 PolarHBondContact O-N 2.69Å; D344-R346 VanDerWaalsContact O-N 3.07Å
347	F	93.3	Very high	91.7	Very high	14 Å²	14	70.9 Å²	70.9	6%	0.061	36%	0.358	C	S	.	.	S	Bend	trans	-121.7	142.1	-177.1	-46.8	-77.1	0	0	0	110.4	L204 P294 F306 L308 M342 D344 M349 V350	L204-F347 HydrophobicContact CD1-CD1 4.16Å; L204-F347 HydrophobicContact CD1-CE1 3.74Å; P294-F347 HydrophobicContact CG-CD1 4.13Å; P294-F347 HydrophobicContact CG-CE1 3.54Å; P294-F347 HydrophobicContact CG-CZ 4.2Å; F306-F347 HydrophobicContact CB-CD1 3.94Å; L308-F347 HydrophobicContact CB-CB 4.47Å; L308-F347 HydrophobicContact CB-CD1 3.88Å; L308-F347 HydrophobicContact CB-CD2 4.4Å; L308-F347 HydrophobicContact CB-CE1 4.2Å; L308-F347 HydrophobicContact CB-CG 3.99Å; L308-F347 HydrophobicContact CD2-CD2 4.05Å; L308-F347 HydrophobicContact CD2-CE1 4.32Å; L308-F347 HydrophobicContact CD2-CE2 3.78Å; L308-F347 HydrophobicContact CD2-CG 4.45Å; L308-F347 HydrophobicContact CD2-CZ 3.93Å; M342-F347 HydrophobicContact CB-CE2 4.2Å; M342-F347 HydrophobicContact CB-CZ 4.3Å; M342-F347 HydrophobicContact CE-CZ 3.85Å; M342-F347 HydrophobicContact SD-CZ 4.39Å; D344-F347 PolarHBondContact O-N 3.16Å; F347-M349 PolarHBondContact O-N 3.06Å; F347-V350 HydrophobicContact CD2-CG2 4.4Å
348	E	94.2	Very high	91.9	Very high	58 Å²	58	72.3 Å²	72.3	27%	0.271	36%	0.363	S	S	.	.	S	Bend	trans	-68.2	-30.2	172.4	-80.7	68.3	-161.6	0	0	111.9	R199 I305 F306 F307 Y366	R199-E348 IonicContact CZ-OE1 3.68Å; R199-E348 IonicContact NH1-OE1 3.7Å; R199-E348 PolarHBondContact NH1-OE1 2.96Å; R199-E348 IonicContact NH2-OE1 3.15Å; R199-E348 PolarHBondContact NH2-OE1 3.47Å; I305-E348 WeakPolarHBondContact CA-OE2 3.28Å; I305-E348 HydrophobicContact CB-CG 4.47Å; I305-E348 HydrophobicContact CG1-CG 4.42Å; I305-E348 HydrophobicContact CG2-CB 4.02Å; I305-E348 HydrophobicContact CG2-CG 3.88Å; F306-E348 PolarHBondContact N-OE2 2.96Å; F306-E348 PolarHBondContact O-N 3.01Å; F306-E348 VanDerWaalsContact O-N 3.08Å; F307-E348 HydrophobicContact CD1-CB 4.34Å; F307-E348 HydrophobicContact CE1-CB 4.06Å; E348-Y366 HydrophobicContact CB-CE1 4.48Å; E348-Y366 HydrophobicContact CB-CE2 4.44Å; E348-Y366 VanDerWaalsContact CG-OH 3.26Å; E348-Y366 WeakPolarHBondContact CG-OH 3.34Å
349	M	94.6	Very high	92.1	Very high	20 Å²	20	69.1 Å²	69.1	10%	0.099	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	136.5	179.2	-163.8	-179.4	-50.1	0	0	111.8	F307 L308 F347 I351 R362 Y366	F307-M349 HydrophobicContact CD1-CB 3.72Å; F307-M349 HydrophobicContact CE1-CB 4.13Å; F307-M349 HydrophobicContact CE1-CE 4.37Å; L308-M349 PolarHBondContact N-O 3.42Å; F347-M349 PolarHBondContact O-N 3.06Å; M349-I351 HydrophobicContact CG-CG1 4.43Å; M349-I351 HydrophobicContact SD-CG1 4.35Å; M349-R362 HydrophobicContact SD-CB 3.78Å; M349-Y366 VanDerWaalsContact CE-CB 3.42Å; M349-Y366 HydrophobicContact CE-CD2 4.12Å; M349-Y366 HydrophobicContact CE-CG 3.86Å
350	V	95.4	Very high	92.5	Very high	22 Å²	22	69 Å²	69	13%	0.133	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	128.5	164.8	-171.7	0	0	0	0	109.3	L308 R310 D344 F347 E352 R362	L308-V350 HydrophobicContact CB-CG2 4.42Å; L308-V350 HydrophobicContact CD2-CG1 4.26Å; L308-V350 HydrophobicContact CD2-CG2 4.29Å; L308-V350 HydrophobicContact CG-CG1 4.49Å; L308-V350 CarbonylContact O-C 3.6Å; L308-V350 WeakPolarHBondContact O-CA 3.03Å; R310-V350 HydrophobicContact CB-CG1 3.92Å; D344-V350 HydrophobicContact CB-CG2 4.37Å; F347-V350 HydrophobicContact CD2-CG2 4.4Å; V350-E352 HydrophobicContact CG1-CG 4.06Å; V350-R362 PolarHBondContact O-NH1 2.95Å
351	I	95.1	Very high	92.8	Very high	5 Å²	5	74.3 Å²	74.3	3%	0.026	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	113.7	-177.4	-57.3	169.4	0	0	0	107.4	F307 L308 I309 R310 M349 E353 A359 I363	F307-I351 HydrophobicContact CB-CD1 4.2Å; L308-I351 PolarHBondContact O-N 3.28Å; I309-I351 HydrophobicContact CG1-CB 4.46Å; I309-I351 HydrophobicContact CG1-CD1 4.19Å; R310-I351 PolarHBondContact N-O 3.46Å; M349-I351 HydrophobicContact CG-CG1 4.43Å; M349-I351 HydrophobicContact SD-CG1 4.35Å; I351-E353 WeakPolarHBondContact CG2-OE2 3.3Å; I351-A359 HydrophobicContact CG2-CB 3.62Å; I351-I363 HydrophobicContact CD1-CD1 3.5Å; I351-I363 VanDerWaalsContact CD1-CD1 3.5Å; I351-I363 HydrophobicContact CD1-CG1 3.57Å
352	E	93.9	Very high	93.1	Very high	78 Å²	78	73 Å²	73	36%	0.364	34%	0.344	S	S	.	.			trans	-120.4	3.4	179.5	-59.7	-165.3	114.5	0	0	112	R310 S312 V350 N354	R310-E352 HydrophobicContact CB-CG 4.29Å; R310-E352 IonicContact CZ-OE1 3.5Å; R310-E352 IonicContact NE-OE1 3.33Å; R310-E352 PolarHBondContact NE-OE1 2.97Å; R310-E352 IonicContact NH2-OE1 3.78Å; R310-E352 PolarHBondContact NH2-OE1 2.82Å; R310-E352 IonicContact NH2-OE2 3.86Å; R310-E352 PolarHBondContact NH2-OE2 3.24Å; S312-E352 PolarHBondContact OG-OE1 3.03Å; V350-E352 HydrophobicContact CG1-CG 4.06Å; E352-N354 PolarHBondContact O-N 3.4Å
353	E	93.3	Very high	93.5	Very high	63 Å²	63	71.2 Å²	71.2	29%	0.294	34%	0.336	S	S	.	.			trans	-64.8	132.2	179.9	-71.7	71.7	-166.3	0	0	111.5	I351 G355 E358 A359 R362	I351-E353 WeakPolarHBondContact CG2-OE2 3.3Å; E353-G355 VanDerWaalsContact C-N 3.28Å; E353-G355 PolarHBondContact O-N 3.14Å; E353-E358 HydrophobicContact CB-CB 4.12Å; E353-E358 HydrophobicContact CG-CB 3.93Å; E353-A359 HydrophobicContact CB-CB 4.16Å; E353-R362 VanDerWaalsContact CD-CD 3.49Å; E353-R362 VanDerWaalsContact CD-NH1 3.33Å; E353-R362 WeakPolarHBondContact OE1-CD 3.34Å; E353-R362 IonicContact OE1-CZ 3.31Å; E353-R362 IonicContact OE1-NE 2.76Å; E353-R362 IonicContact OE1-NH1 3.25Å; E353-R362 PolarHBondContact OE1-NH1 3.31Å; E353-R362 IonicContact OE2-NH1 3.15Å; E353-R362 PolarHBondContact OE2-NH1 2.95Å
354	N	90.3	Very high	93.8	Very high	172 Å²	172	67.7 Å²	67.7	92%	0.92	32%	0.316	S	S	*	.	S	Bend	trans	-72.6	-22.8	177	-63.9	-36	0	0	0	113.1	E352	E352-N354 PolarHBondContact O-N 3.4Å
355	G	92.8	Very high	94.2	Very high	24 Å²	24	66.3 Å²	66.3	25%	0.247	31%	0.313	C	S	.	.	S	Bend	trans	-101.8	135.2	-176	0	0	0	0	0	112.5	E353 R357 E358 A359	E353-G355 VanDerWaalsContact C-N 3.28Å; E353-G355 PolarHBondContact O-N 3.14Å; G355-R357 VanDerWaalsContact C-N 3.29Å; G355-R357 PolarHBondContact O-N 3.07Å; G355-E358 VanDerWaalsContact CA-OE2 3.31Å; G355-E358 WeakPolarHBondContact CA-OE2 3.48Å; G355-E358 PolarHBondContact O-N 3.43Å; G355-A359 WeakPolarHBondContact O-CB 3.43Å; G355-A359 PolarHBondContact O-N 3.32Å
356	L	94.7	Very high	94.6	Very high	81 Å²	81	62.8 Å²	62.8	42%	0.424	29%	0.289	S	S	.	.	H	α-helix	trans	-59.3	-41.1	178.4	178.9	64.6	0	0	0	111.7	A220 L221 T360	A220-L356 HydrophobicContact CB-CD1 4.02Å; A220-L356 HydrophobicContact CB-CD2 4.17Å; L221-L356 HydrophobicContact CD2-CD1 3.65Å; L221-L356 HydrophobicContact CG-CD1 4Å; L356-T360 WeakPolarHBondContact O-CB 3.42Å; L356-T360 PolarHBondContact O-N 3.47Å; L356-T360 PolarHBondContact O-OG1 3.5Å
357	R	95.4	Very high	94.9	Very high	202 Å²	202	57.8 Å²	57.8	76%	0.762	27%	0.271	S	S	*	.	H	α-helix	trans	-64.9	-43.9	-177	-173.1	-178.8	-177.3	-149.7	1.6	111.4	G355 R361	G355-R357 VanDerWaalsContact C-N 3.29Å; G355-R357 PolarHBondContact O-N 3.07Å; R357-R361 VanDerWaalsContact O-CB 3.24Å; R357-R361 WeakPolarHBondContact O-CB 3.46Å; R357-R361 PolarHBondContact O-N 3.47Å
358	E	95.6	Very high	95	Very high	90 Å²	90	61.4 Å²	61.4	42%	0.421	29%	0.288	S	S	.	.	H	α-helix	trans	-67.8	-45.6	-179.7	-66.1	67.4	-147.8	0	0	110.9	E353 G355 R361 R362	E353-E358 HydrophobicContact CB-CB 4.12Å; E353-E358 HydrophobicContact CG-CB 3.93Å; G355-E358 VanDerWaalsContact CA-OE2 3.31Å; G355-E358 WeakPolarHBondContact CA-OE2 3.48Å; G355-E358 PolarHBondContact O-N 3.43Å; E358-R361 PolarHBondContact O-N 3.22Å; E358-R362 PolarHBondContact O-N 2.99Å
359	A	95.6	Very high	95	Very high	5 Å²	5	65.3 Å²	65.3	4%	0.041	30%	0.304	C	S	.	.	H	α-helix	trans	-57.7	-52.8	174.8	0	0	0	0	0	111.5	L221 I351 E353 G355 R361 R362 I363	L221-A359 HydrophobicContact CD2-CB 3.99Å; I351-A359 HydrophobicContact CG2-CB 3.62Å; E353-A359 HydrophobicContact CB-CB 4.16Å; G355-A359 WeakPolarHBondContact O-CB 3.43Å; G355-A359 PolarHBondContact O-N 3.32Å; A359-R361 VanDerWaalsContact C-N 3.34Å; A359-R361 PolarHBondContact O-N 3.14Å; A359-R362 PolarHBondContact O-N 3.4Å; A359-I363 PolarHBondContact O-N 2.95Å
360	T	96.4	Very high	95	Very high	3 Å²	3	65.3 Å²	65.3	2%	0.018	30%	0.303	C	S	.	.	H	α-helix	trans	-63.8	-38.7	-179.5	-57.6	0	0	0	0	111.8	E224 I225 L356 R362 I363 I364	E224-T360 HydrophobicContact CB-CG2 3.9Å; E224-T360 HydrophobicContact CG-CG2 3.48Å; E224-T360 VanDerWaalsContact CG-CG2 3.48Å; I225-T360 HydrophobicContact CG1-CG2 3.91Å; L356-T360 WeakPolarHBondContact O-CB 3.42Å; L356-T360 PolarHBondContact O-N 3.47Å; L356-T360 PolarHBondContact O-OG1 3.5Å; T360-R362 VanDerWaalsContact C-N 3.3Å; T360-R362 PolarHBondContact O-N 2.81Å; T360-I363 PolarHBondContact O-N 3.46Å; T360-I364 HydrophobicContact CG2-CD1 3.42Å; T360-I364 VanDerWaalsContact CG2-CD1 3.42Å; T360-I364 HydrophobicContact CG2-CG1 3.99Å; T360-I364 WeakPolarHBondContact O-CB 3.19Å; T360-I364 VanDerWaalsContact O-CG1 3.29Å; T360-I364 WeakPolarHBondContact O-CG1 3.46Å; T360-I364 PolarHBondContact O-N 2.94Å
361	R	96.1	Very high	94.9	Very high	162 Å²	162	66.1 Å²	66.1	61%	0.611	31%	0.306	S	S	*	.	H	α-helix	trans	-59.4	-39.3	176.8	-172.7	-173.6	68.3	81.3	0.6	112.2	R357 E358 A359 S365	R357-R361 VanDerWaalsContact O-CB 3.24Å; R357-R361 WeakPolarHBondContact O-CB 3.46Å; R357-R361 PolarHBondContact O-N 3.47Å; E358-R361 PolarHBondContact O-N 3.22Å; A359-R361 VanDerWaalsContact C-N 3.34Å; A359-R361 PolarHBondContact O-N 3.14Å; R361-S365 VanDerWaalsContact O-CB 3.32Å; R361-S365 WeakPolarHBondContact O-CB 3.32Å; R361-S365 PolarHBondContact O-N 3.47Å
362	R	96.1	Very high	94.7	Very high	87 Å²	87	68.7 Å²	68.7	33%	0.328	32%	0.318	S	S	.	.	H	α-helix	trans	-65.9	-47.2	176.6	-72	-174.7	67.8	-160.9	-4.4	111.5	M349 V350 E353 E358 A359 T360 S365 Y366	M349-R362 HydrophobicContact SD-CB 3.78Å; V350-R362 PolarHBondContact O-NH1 2.95Å; E353-R362 VanDerWaalsContact CD-CD 3.49Å; E353-R362 VanDerWaalsContact CD-NH1 3.33Å; E353-R362 WeakPolarHBondContact OE1-CD 3.34Å; E353-R362 IonicContact OE1-CZ 3.31Å; E353-R362 IonicContact OE1-NE 2.76Å; E353-R362 IonicContact OE1-NH1 3.25Å; E353-R362 PolarHBondContact OE1-NH1 3.31Å; E353-R362 IonicContact OE2-NH1 3.15Å; E353-R362 PolarHBondContact OE2-NH1 2.95Å; E358-R362 PolarHBondContact O-N 2.99Å; A359-R362 PolarHBondContact O-N 3.4Å; T360-R362 VanDerWaalsContact C-N 3.3Å; T360-R362 PolarHBondContact O-N 2.81Å; R362-S365 PolarHBondContact O-N 2.87Å; R362-Y366 PolarHBondContact O-N 3.17Å; R362-Y366 VanDerWaalsContact O-N 3.1Å
363	I	96.5	Very high	94.6	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-58.3	-50.9	176.6	-63.2	170.8	0	0	0	110.3	L221 I225 F307 I351 A359 T360 S365 Y366 L367	L221-I363 HydrophobicContact CD2-CD1 4.18Å; I225-I363 HydrophobicContact CD1-CB 4.39Å; I225-I363 HydrophobicContact CD1-CD1 3.76Å; I225-I363 HydrophobicContact CD1-CG2 3.78Å; I225-I363 HydrophobicContact CG1-CG2 4.22Å; F307-I363 HydrophobicContact CD2-CG1 4.4Å; F307-I363 HydrophobicContact CD2-CG2 4.01Å; F307-I363 HydrophobicContact CE2-CG2 3.63Å; F307-I363 HydrophobicContact CZ-CG2 4.29Å; I351-I363 HydrophobicContact CD1-CD1 3.5Å; I351-I363 VanDerWaalsContact CD1-CD1 3.5Å; I351-I363 HydrophobicContact CD1-CG1 3.57Å; A359-I363 PolarHBondContact O-N 2.95Å; T360-I363 PolarHBondContact O-N 3.46Å; I363-S365 PolarHBondContact O-N 2.95Å; I363-Y366 PolarHBondContact O-N 3.47Å; I363-L367 HydrophobicContact CG2-CD1 3.67Å; I363-L367 HydrophobicContact CG2-CG 4.13Å; I363-L367 WeakPolarHBondContact O-CG 3.36Å; I363-L367 PolarHBondContact O-N 3.38Å
364	I	96.2	Very high	94.5	Very high	19 Å²	19	62.5 Å²	62.5	10%	0.097	29%	0.29	C	S	.	.	H	α-helix	trans	-57.2	-49.3	-179.8	-73.7	168.8	0	0	0	110.5	H228 F229 T360 Y366 L367 E368	H228-I364 HydrophobicContact CB-CD1 3.76Å; H228-I364 HydrophobicContact CB-CG1 4.34Å; H228-I364 VanDerWaalsContact CD2-CG2 3.48Å; H228-I364 WeakPolarHBondContact CD2-CG2 3.42Å; H228-I364 VanDerWaalsContact NE2-CG2 3.26Å; H228-I364 WeakPolarHBondContact NE2-CG2 3.44Å; F229-I364 HydrophobicContact CE2-CB 4.46Å; F229-I364 HydrophobicContact CE2-CG1 3.98Å; F229-I364 HydrophobicContact CZ-CB 4.44Å; F229-I364 HydrophobicContact CZ-CG1 4.42Å; F229-I364 HydrophobicContact CZ-CG2 4.13Å; T360-I364 HydrophobicContact CG2-CD1 3.42Å; T360-I364 VanDerWaalsContact CG2-CD1 3.42Å; T360-I364 HydrophobicContact CG2-CG1 3.99Å; T360-I364 WeakPolarHBondContact O-CB 3.19Å; T360-I364 VanDerWaalsContact O-CG1 3.29Å; T360-I364 WeakPolarHBondContact O-CG1 3.46Å; T360-I364 PolarHBondContact O-N 2.94Å; I364-Y366 VanDerWaalsContact C-N 3.27Å; I364-Y366 PolarHBondContact O-N 2.98Å; I364-L367 PolarHBondContact O-N 3.4Å; I364-L367 VanDerWaalsContact O-N 3.09Å; I364-E368 HydrophobicContact CG2-CG 4.21Å; I364-E368 WeakPolarHBondContact CG2-OE1 3.28Å; I364-E368 WeakPolarHBondContact O-CG 3.46Å; I364-E368 PolarHBondContact O-N 3.42Å
365	S	96.1	Very high	94.5	Very high	44 Å²	44	57.6 Å²	57.6	31%	0.308	26%	0.262	S	S	.	.	H	α-helix	trans	-60	-37.2	-179.3	-176.1	0	0	0	0	112.7	R361 R362 I363 K369	R361-S365 VanDerWaalsContact O-CB 3.32Å; R361-S365 WeakPolarHBondContact O-CB 3.32Å; R361-S365 PolarHBondContact O-N 3.47Å; R362-S365 PolarHBondContact O-N 2.87Å; I363-S365 PolarHBondContact O-N 2.95Å; S365-K369 WeakPolarHBondContact O-CG 3.37Å; S365-K369 PolarHBondContact O-N 3.21Å
366	Y	96.5	Very high	94.1	Very high	65 Å²	65	59.3 Å²	59.3	26%	0.255	26%	0.261	S	S	.	.	H	α-helix	trans	-68.4	-45.8	173.8	177.8	-86.2	0	0	0	111.8	I305 F307 E348 M349 R362 I363 I364 E368 K369 Y370	I305-Y366 HydrophobicContact CD1-CE1 4.4Å; I305-Y366 HydrophobicContact CG2-CE1 4.13Å; F307-Y366 AromaticContact CE1-CD1 3.82Å; F307-Y366 HydrophobicContact CE1-CD1 3.82Å; F307-Y366 HydrophobicContact CE1-CE1 4.01Å; F307-Y366 HydrophobicContact CE1-CG 4.41Å; F307-Y366 AromaticContact CZ-CD1 3.62Å; F307-Y366 HydrophobicContact CZ-CD1 3.62Å; F307-Y366 AromaticContact CZ-CE1 3.98Å; F307-Y366 HydrophobicContact CZ-CE1 3.98Å; F307-Y366 HydrophobicContact CZ-CG 4.48Å; E348-Y366 HydrophobicContact CB-CE1 4.48Å; E348-Y366 HydrophobicContact CB-CE2 4.44Å; E348-Y366 VanDerWaalsContact CG-OH 3.26Å; E348-Y366 WeakPolarHBondContact CG-OH 3.34Å; M349-Y366 VanDerWaalsContact CE-CB 3.42Å; M349-Y366 HydrophobicContact CE-CD2 4.12Å; M349-Y366 HydrophobicContact CE-CG 3.86Å; R362-Y366 PolarHBondContact O-N 3.17Å; R362-Y366 VanDerWaalsContact O-N 3.1Å; I363-Y366 PolarHBondContact O-N 3.47Å; I364-Y366 VanDerWaalsContact C-N 3.27Å; I364-Y366 PolarHBondContact O-N 2.98Å; Y366-E368 VanDerWaalsContact C-N 3.33Å; Y366-E368 PolarHBondContact O-N 3.48Å; Y366-K369 WeakPolarHBondContact O-CB 3.31Å; Y366-K369 PolarHBondContact O-N 3.15Å; Y366-Y370 PolarHBondContact O-N 3.49Å
367	L	95.9	Very high	93.4	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-65.9	-33.5	-179.1	-70	-179.7	0	0	0	112.7	I201 I225 F229 L283 F307 I363 I364 Y370 I371	I201-L367 HydrophobicContact CD1-CD1 3.98Å; I201-L367 HydrophobicContact CD1-CD2 3.48Å; I201-L367 VanDerWaalsContact CD1-CD2 3.48Å; I201-L367 HydrophobicContact CD1-CG 4.4Å; I201-L367 HydrophobicContact CG1-CD2 4.05Å; I225-L367 HydrophobicContact CG2-CD1 4.2Å; F229-L367 HydrophobicContact CE1-CB 4.39Å; F229-L367 HydrophobicContact CE2-CB 3.95Å; F229-L367 HydrophobicContact CE2-CD1 3.82Å; F229-L367 HydrophobicContact CZ-CB 3.56Å; F229-L367 HydrophobicContact CZ-CD1 4.31Å; L283-L367 HydrophobicContact CD1-CB 4.04Å; L283-L367 HydrophobicContact CD1-CD1 4.24Å; L283-L367 HydrophobicContact CD1-CD2 4.37Å; L283-L367 HydrophobicContact CD1-CG 4.45Å; F307-L367 HydrophobicContact CE2-CD1 4.41Å; F307-L367 HydrophobicContact CE2-CD2 4.11Å; F307-L367 HydrophobicContact CE2-CG 4.3Å; F307-L367 HydrophobicContact CZ-CD2 3.96Å; F307-L367 HydrophobicContact CZ-CG 4.28Å; I363-L367 HydrophobicContact CG2-CD1 3.67Å; I363-L367 HydrophobicContact CG2-CG 4.13Å; I363-L367 WeakPolarHBondContact O-CG 3.36Å; I363-L367 PolarHBondContact O-N 3.38Å; I364-L367 PolarHBondContact O-N 3.4Å; I364-L367 VanDerWaalsContact O-N 3.09Å; L367-Y370 WeakPolarHBondContact O-CB 3.46Å; L367-Y370 PolarHBondContact O-N 3.33Å; L367-I371 WeakPolarHBondContact O-CG1 3.32Å; L367-I371 PolarHBondContact O-N 3.3Å
368	E	94.2	Very high	92.1	Very high	90 Å²	90	53.7 Å²	53.7	42%	0.421	24%	0.241	S	C	.	.	H	α-helix	trans	-63	-45.8	172.5	-74.6	172.3	167.2	0	0	111.6	H228 F229 I364 Y366 Y370 I371 H372	H228-E368 IonicContact CD2-OE1 3.21Å; H228-E368 IonicContact CE1-OE1 2.63Å; H228-E368 IonicContact NE2-OE1 3.93Å; H228-E368 PolarHBondContact NE2-OE1 3.32Å; F229-E368 HydrophobicContact CE1-CG 4Å; F229-E368 HydrophobicContact CZ-CG 4.15Å; I364-E368 HydrophobicContact CG2-CG 4.21Å; I364-E368 WeakPolarHBondContact CG2-OE1 3.28Å; I364-E368 WeakPolarHBondContact O-CG 3.46Å; I364-E368 PolarHBondContact O-N 3.42Å; Y366-E368 VanDerWaalsContact C-N 3.33Å; Y366-E368 PolarHBondContact O-N 3.48Å; E368-Y370 VanDerWaalsContact C-N 3.27Å; E368-Y370 PolarHBondContact O-N 2.95Å; E368-I371 PolarHBondContact O-N 3.31Å; E368-H372 PolarHBondContact O-N 3.13Å
369	K	93.9	Very high	90.5	Very high	139 Å²	139	55.9 Å²	55.9	60%	0.604	25%	0.249	S	C	*	.	H	α-helix	trans	-61	-39.1	173	-68	173.9	-174.7	-179.6	0	111.3	S365 Y366 H372 A373	S365-K369 WeakPolarHBondContact O-CG 3.37Å; S365-K369 PolarHBondContact O-N 3.21Å; Y366-K369 WeakPolarHBondContact O-CB 3.31Å; Y366-K369 PolarHBondContact O-N 3.15Å; K369-H372 PolarHBondContact O-N 2.75Å; K369-A373 PolarHBondContact O-N 3.36Å
370	Y	95	Very high	88.6	Confident	20 Å²	20	61.1 Å²	61.1	8%	0.078	28%	0.277	C	S	.	.	H	α-helix	trans	-66.5	-42.3	177.5	-176.6	-122.1	0	0	0	112.3	V146 R199 L283 I305 Y366 L367 E368 H372 A373 L374	V146-Y370 HydrophobicContact CG1-CE2 4.22Å; R199-Y370 WeakPolarHBondContact CB-OH 3.22Å; R199-Y370 VanDerWaalsContact CG-OH 3.31Å; R199-Y370 WeakPolarHBondContact CG-OH 3.44Å; R199-Y370 PolarHBondContact N-OH 2.9Å; L283-Y370 HydrophobicContact CD2-CD1 3.73Å; L283-Y370 HydrophobicContact CD2-CE1 4.04Å; I305-Y370 HydrophobicContact CD1-CD1 3.82Å; I305-Y370 HydrophobicContact CD1-CD2 4.41Å; I305-Y370 HydrophobicContact CD1-CE1 3.59Å; I305-Y370 HydrophobicContact CD1-CE2 4.25Å; I305-Y370 HydrophobicContact CD1-CG 4.23Å; Y366-Y370 PolarHBondContact O-N 3.49Å; L367-Y370 WeakPolarHBondContact O-CB 3.46Å; L367-Y370 PolarHBondContact O-N 3.33Å; E368-Y370 VanDerWaalsContact C-N 3.27Å; E368-Y370 PolarHBondContact O-N 2.95Å; Y370-H372 VanDerWaalsContact C-N 3.3Å; Y370-H372 PolarHBondContact O-N 3.39Å; Y370-A373 CarbonylContact O-C 3.5Å; Y370-A373 PolarHBondContact O-N 2.63Å; Y370-A373 VanDerWaalsContact O-N 3.14Å; Y370-L374 HydrophobicContact CD1-CD1 3.87Å; Y370-L374 HydrophobicContact CD1-CG 4.35Å; Y370-L374 HydrophobicContact CD2-CG 4.43Å; Y370-L374 HydrophobicContact CE1-CD1 3.47Å; Y370-L374 VanDerWaalsContact CE1-CD1 3.47Å; Y370-L374 HydrophobicContact CE1-CD2 4.37Å; Y370-L374 HydrophobicContact CE1-CG 3.97Å; Y370-L374 HydrophobicContact CE2-CD1 4.45Å; Y370-L374 HydrophobicContact CE2-CD2 4.16Å; Y370-L374 HydrophobicContact CE2-CG 4.03Å; Y370-L374 WeakPolarHBondContact O-CB 3.48Å; Y370-L374 WeakPolarHBondContact O-CG 3.46Å; Y370-L374 PolarHBondContact O-N 3.28Å
371	I	92.4	Very high	86.5	Confident	40 Å²	40	66.9 Å²	66.9	21%	0.205	31%	0.307	C	S	.	.	H	α-helix	trans	-58.7	-44.1	173.4	-72.6	170.2	0	0	0	110.7	F229 L283 L367 E368 A373 L374 H375	F229-I371 HydrophobicContact CD1-CD1 3.77Å; F229-I371 HydrophobicContact CE1-CD1 3.62Å; L283-I371 HydrophobicContact CD1-CD1 3.66Å; L283-I371 HydrophobicContact CD1-CG1 3.91Å; L283-I371 HydrophobicContact CD2-CG1 3.92Å; L283-I371 HydrophobicContact CG-CD1 4.04Å; L283-I371 HydrophobicContact CG-CG1 3.91Å; L367-I371 WeakPolarHBondContact O-CG1 3.32Å; L367-I371 PolarHBondContact O-N 3.3Å; E368-I371 PolarHBondContact O-N 3.31Å; I371-A373 VanDerWaalsContact C-N 3.3Å; I371-A373 PolarHBondContact O-N 3.5Å; I371-L374 WeakPolarHBondContact O-CB 3.48Å; I371-L374 PolarHBondContact O-N 2.99Å; I371-L374 VanDerWaalsContact O-N 3.12Å; I371-H375 PolarHBondContact O-N 3.3Å; I371-H375 VanDerWaalsContact O-N 3.09Å; I371-H375 PolarHBondContact O-ND1 3.5Å
372	H	91.2	Very high	84.1	Confident	59 Å²	59	65.1 Å²	65.1	27%	0.273	31%	0.306	S	S	.	.	H	α-helix	trans	-64.9	-34.8	177.5	-173.8	72.3	0	0	0	111.9	E368 K369 Y370 H377	E368-H372 PolarHBondContact O-N 3.13Å; K369-H372 PolarHBondContact O-N 2.75Å; Y370-H372 VanDerWaalsContact C-N 3.3Å; Y370-H372 PolarHBondContact O-N 3.39Å; H372-H377 AromaticContact CE1-CD2 3.35Å; H372-H377 PolarHBondContact CE1-CD2 3.31Å; H372-H377 AromaticContact CE1-CG 3.97Å; H372-H377 AromaticContact CE1-NE2 3.77Å; H372-H377 AromaticContact ND1-CD2 3.21Å; H372-H377 PolarHBondContact ND1-CD2 3.49Å; H372-H377 AromaticContact ND1-NE2 3.14Å; H372-H377 PolarHBondContact ND1-NE2 3.26Å; H372-H377 VanDerWaalsContact ND1-NE2 3.14Å
373	A	92.8	Very high	81.1	Confident	9 Å²	9	71.2 Å²	71.2	7%	0.074	34%	0.343	C	S	.	.	H	α-helix	trans	-71.8	-27.6	171.9	0	0	0	0	0	113.4	R144 V146 K369 Y370 I371	R144-A373 VanDerWaalsContact CZ-O 3.28Å; R144-A373 PolarHBondContact NH1-O 2.66Å; R144-A373 PolarHBondContact NH2-O 2.94Å; V146-A373 HydrophobicContact CG1-CB 4.28Å; K369-A373 PolarHBondContact O-N 3.36Å; Y370-A373 CarbonylContact O-C 3.5Å; Y370-A373 PolarHBondContact O-N 2.63Å; Y370-A373 VanDerWaalsContact O-N 3.14Å; I371-A373 VanDerWaalsContact C-N 3.3Å; I371-A373 PolarHBondContact O-N 3.5Å
374	L	91.8	Very high	80.3	Confident	1 Å²	1	74.8 Å²	74.8	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-78.2	-27.4	179.1	-80.3	177.3	0	0	0	114	R144 V146 L283 Y370 I371	R144-L374 PolarHBondContact NH2-O 3.49Å; V146-L374 HydrophobicContact CG1-CD2 3.95Å; V146-L374 HydrophobicContact CG1-CG 4.49Å; L283-L374 HydrophobicContact CD2-CD1 4.26Å; Y370-L374 HydrophobicContact CD1-CD1 3.87Å; Y370-L374 HydrophobicContact CD1-CG 4.35Å; Y370-L374 HydrophobicContact CD2-CG 4.43Å; Y370-L374 HydrophobicContact CE1-CD1 3.47Å; Y370-L374 VanDerWaalsContact CE1-CD1 3.47Å; Y370-L374 HydrophobicContact CE1-CD2 4.37Å; Y370-L374 HydrophobicContact CE1-CG 3.97Å; Y370-L374 HydrophobicContact CE2-CD1 4.45Å; Y370-L374 HydrophobicContact CE2-CD2 4.16Å; Y370-L374 HydrophobicContact CE2-CG 4.03Å; Y370-L374 WeakPolarHBondContact O-CB 3.48Å; Y370-L374 WeakPolarHBondContact O-CG 3.46Å; Y370-L374 PolarHBondContact O-N 3.28Å; I371-L374 WeakPolarHBondContact O-CB 3.48Å; I371-L374 PolarHBondContact O-N 2.99Å; I371-L374 VanDerWaalsContact O-N 3.12Å
375	H	88.9	Confident	79.5	Confident	69 Å²	69	77.7 Å²	77.7	32%	0.319	37%	0.373	S	S	.	.	S	Bend	trans	-103.6	140	178.2	-62	85.1	0	0	0	110.4	I371	I371-H375 PolarHBondContact O-N 3.3Å; I371-H375 VanDerWaalsContact O-N 3.09Å; I371-H375 PolarHBondContact O-ND1 3.5Å
376	Y	84.6	Confident	78.5	Confident	61 Å²	61	79.6 Å²	79.6	24%	0.239	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-83.5	126.1	169.9	176.5	-99.7	0	0	0	108.5	K93 F152 H378	K93-Y376 HydrophobicContact CB-CE1 4.38Å; K93-Y376 HydrophobicContact CD-CE1 4.3Å; K93-Y376 HydrophobicContact CG-CE1 4.35Å; F152-Y376 AromaticContact CD2-CD2 3.74Å; F152-Y376 HydrophobicContact CD2-CD2 3.74Å; F152-Y376 AromaticContact CD2-CE2 3.77Å; F152-Y376 HydrophobicContact CD2-CE2 3.77Å; F152-Y376 HydrophobicContact CD2-CG 4.14Å; F152-Y376 AromaticContact CE2-CD1 3.96Å; F152-Y376 HydrophobicContact CE2-CD1 3.96Å; F152-Y376 AromaticContact CE2-CD2 3.57Å; F152-Y376 HydrophobicContact CE2-CD2 3.57Å; F152-Y376 HydrophobicContact CE2-CE1 4.39Å; F152-Y376 HydrophobicContact CE2-CE2 4.03Å; F152-Y376 AromaticContact CE2-CG 3.53Å; F152-Y376 HydrophobicContact CE2-CG 3.53Å; Y376-H378 AromaticContact CE1-ND1 3.86Å
377	H	79.6	Confident	77.5	Confident	84 Å²	84	80.4 Å²	80.4	39%	0.389	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-103.5	136.2	175.2	-66.4	-81.1	0	0	0	109.1	H372	H372-H377 AromaticContact CE1-CD2 3.35Å; H372-H377 PolarHBondContact CE1-CD2 3.31Å; H372-H377 AromaticContact CE1-CG 3.97Å; H372-H377 AromaticContact CE1-NE2 3.77Å; H372-H377 AromaticContact ND1-CD2 3.21Å; H372-H377 PolarHBondContact ND1-CD2 3.49Å; H372-H377 AromaticContact ND1-NE2 3.14Å; H372-H377 PolarHBondContact ND1-NE2 3.26Å; H372-H377 VanDerWaalsContact ND1-NE2 3.14Å
378	H	68.6	Low	76.3	Confident	80 Å²	80	85.4 Å²	85.4	37%	0.37	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-75.8	140.5	174.7	-145.1	60.5	0	0	0	108.6	Y376 D380 D381	Y376-H378 AromaticContact CE1-ND1 3.86Å; H378-D380 IonicContact CD2-OD2 3.97Å; H378-D380 PolarHBondContact CD2-OD2 3.45Å; H378-D380 IonicContact NE2-OD2 3.58Å; H378-D380 PolarHBondContact O-N 3.46Å; H378-D380 VanDerWaalsContact O-N 3.09Å; H378-D381 WeakPolarHBondContact CB-OD2 3.43Å; H378-D381 PolarHBondContact N-OD2 3.28Å; H378-D381 WeakPolarHBondContact O-CB 3.5Å; H378-D381 PolarHBondContact O-N 3.11Å
379	K	62.1	Low	75.2	Confident	137 Å²	137	85.1 Å²	85.1	60%	0.596	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-60.2	-21.2	178.2	-69.7	-172.3	-179.2	175.8	0	112.8	E151 D381	E151-K379 WeakPolarHBondContact OE1-CE 3.45Å; E151-K379 IonicContact OE1-NZ 3.16Å; E151-K379 PolarHBondContact OE1-NZ 3.35Å; K379-D381 VanDerWaalsContact C-N 3.27Å; K379-D381 PolarHBondContact O-N 3.44Å
380	D	55.1	Low	73.8	Confident	115 Å²	115	81.3 Å²	81.3	62%	0.615	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-78.2	-9.7	177.8	-55.9	-26.5	0	0	0	113.2	H378 E382	H378-D380 IonicContact CD2-OD2 3.97Å; H378-D380 PolarHBondContact CD2-OD2 3.45Å; H378-D380 IonicContact NE2-OD2 3.58Å; H378-D380 PolarHBondContact O-N 3.46Å; H378-D380 VanDerWaalsContact O-N 3.09Å; D380-E382 VanDerWaalsContact C-N 3.32Å
381	D	51.9	Low	72.2	Confident	123 Å²	123	86 Å²	86	66%	0.658	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-87	1	177.7	-60.1	-39.9	0	0	0	112.7	H378 K379	H378-D381 WeakPolarHBondContact CB-OD2 3.43Å; H378-D381 PolarHBondContact N-OD2 3.28Å; H378-D381 WeakPolarHBondContact O-CB 3.5Å; H378-D381 PolarHBondContact O-N 3.11Å; K379-D381 VanDerWaalsContact C-N 3.27Å; K379-D381 PolarHBondContact O-N 3.44Å
382	E	46.1	Very low	70.5	Confident	126 Å²	126	89.8 Å²	89.8	59%	0.589	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-104	18.1	-178.1	-70.9	-172.7	165.4	0	0	114.3	D380	D380-E382 VanDerWaalsContact C-N 3.32Å
383	I	33.2	Very low	68.6	Low	214 Å²	214	92.6 Å²	92.6	100%	1.097	45%	0.45	S	S	*	.			trans	-99.7	0	178.3	-57.3	178.1	0	0	0	112.2

Retrieved 383 of 383 residues in 152.6 ms (Link to these results)

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